Model name: model_name=EAM_Dynamo_Olsson_2009_Fe__MO_024705128470_000
a1: a1=[-1, 1, 0]
a2: a2=[0, 0, 1]
a3: a3=[1, 1, 0]
Species: species=Fe
Lattice type: short_name=bcc
Lattice constant (meters) and cohesive energy (J): a=2.870000079274177
cohesive_energy=4.280336473607806
mass=55.845
Min. tilt angle (degrees): theta_min=0.0
Max. tilt angle (degrees): theta_max=180.0
Max. denominator: max_denominator=8
Lattice constant (meters) and cohesive energy (J): cohesive_energy_curve=[2.25653761485828e-19, 3.0661334897848197e-19, 3.58285147601616e-19, 4.0171534961945396e-19, 4.39935273223524e-19, 4.7385976127184e-19, 5.04039962526498e-19, 5.308652059095599e-19, 5.545886353291979e-19, 5.75455383810414e-19, 5.9374262791089e-19, 6.0971632895187e-19, 6.23626426488258e-19, 6.356892143656439e-19, 6.461001581333759e-19, 6.55027486338024e-19, 6.62621803583184e-19, 6.69006477469674e-19, 6.742728320656319e-19, 6.78491363142954e-19, 6.817085338240259e-19, 6.83964398524698e-19, 6.852958073075519e-19, 6.85731599352e-19, 6.8525895724497e-19, 6.837256742062319e-19, 6.809378868630719e-19, 6.76669688310096e-19, 6.70658321579328e-19, 6.62599373110308e-19, 6.521323531603859e-19, 6.388374914514539e-19, 6.222197154036059e-19, 6.016894240155299e-19, 5.765432617449e-19, 5.45906440149552e-19, 5.086766617052939e-19, 4.63442408797572e-19, 4.0839322182996596e-19, 3.4118832074020195e-19, 2.58740311154562e-19, 1.5694409610141118e-19, 3.02820996885804e-20, -1.28690031596148e-19, -3.30142915025406e-19, -5.881558379881319e-19, -9.226166190421679e-19, -1.362593548858176e-18, -1.95427097108784e-18, -2.77492186478898e-18, -3.9607568786777395e-18, -5.7693579502023e-18]
Min. number unit cell repetitions along x direction: x_repeat=1
Min. number unit cell repetitions along z direction: z_repeat=1
Min. cell height (Angstroms): min_cell_height=10.0
Offset grid fraction (as fraction of lattice parameter): offset_grid_frac=0.25


Isolated atom energy: -1e-07 eV

========================================
theta = 0.0
========================================

Energy: 0.013096259017397662
Energy: 0.013767547177376995
Energy: 0.2244675701167898
Energy: 0.22449455952246514
Energy: 0.22577283132303413
Energy: 0.013442566796434465
Energy: 0.013767547177376995
Energy: 1.1077142224266832
Energy: 0.22468025471893702
Energy: 0.22446504015559457
Energy: 0.22455656659655665
Energy: 0.2245023971221112
Energy: 0.22446757011631993
Energy: 0.22468025471893702
Energy: 1.109004164432863
Energy: 0.013733240503186335
Energy: 0.22452120487203242
Energy: 0.22449132954731407
Energy: 0.22449455952246514
Energy: 0.2244650401560921
Energy: 0.013733240503683889
Energy: 0.013230528603547741
Energy: 0.22508516709006127
Energy: 0.22452176370593463
Energy: 0.2257728313225642
Energy: 0.22455656659655665
Energy: 0.2245212048715625
Energy: 0.22508516709006127
Energy: 1.1071707108757487
Energy: 0.22449594734380238
Energy: 0.013442566796904377
Energy: 0.22450239712258113
Energy: 0.224491329547784
Energy: 0.22452176370593463
Energy: 0.2244959473433048
Energy: 0.013249200072193502

minimum gb energy = 0.013096259017397662 eV
minimum distance =  2.48442338521907 Angstroms
sigma value = 1


========================================
theta = 20.049975724151484
========================================

Energy: 1.9985995683991855
Energy: 1.4328018037884802
Energy: 1.376701337941864
Energy: 1.3560829886185801
Energy: 1.376193124181899
Energy: 1.433204358425111
Energy: 1.357746327265801
Energy: 1.4525886776978647
Energy: 1.3654037955780594
Energy: 1.268945526947863
Energy: 1.3653329716079385
Energy: 1.5016718476526747
Energy: 1.2694787722480136
Energy: 1.3680225724544033
Energy: 1.4539044810887969
Energy: 1.3416043758692084
Energy: 1.3677856369181254
Energy: 1.368865245897999
Energy: 1.3429625578074063
Energy: 1.3635789834366385
Energy: 1.4482497202295925
Energy: 1.4749596085317476
Energy: 1.363164652114544
Energy: 1.365604601817587
Energy: 1.2667539198754008
Energy: 1.363769366018121
Energy: 1.3664908515496792
Energy: 1.2678298521257148
Energy: 1.4573728655018818
Energy: 1.363626180240481
Energy: 1.3438914406157048
Energy: 1.4460026893652356
Energy: 1.4469182051237675
Energy: 1.3516398155201585
Energy: 1.4471755000750457
Energy: 1.4461488174691033
Energy: 1.3449160947334642
Energy: 1.4455132370301642
Energy: 1.4464367569613277
Energy: 1.475383279665472
Energy: 1.4464873477095723
Energy: 1.445605535538341
Energy: 1.2675499740665035
Energy: 1.2682383519962217
Energy: 1.2693268667830793
Energy: 1.2855361453284082
Energy: 1.4470075182098368
Energy: 1.2682885484921773
Energy: 1.2646389399989164
Energy: 1.4470537127978482
Energy: 1.4490948936461703
Energy: 1.350449985039691
Energy: 1.4491197927981578
Energy: 1.4761782693666843
Energy: 1.2641920763309222
Energy: 1.4456794542033455
Energy: 1.4467798192279993
Energy: 1.354275629469348
Energy: 1.4468044737608134
Energy: 1.4506914572477325
Energy: 1.2845810266948785
Energy: 1.2688225308030496
Energy: 1.3649478034455356
Energy: 1.2684532812959637
Energy: 1.363220966243574
Energy: 1.2701733018419321
Energy: 1.346227809843898
Energy: 1.364192078394463
Energy: 1.4282091415392622
Energy: 1.4198802628420908
Energy: 1.3640134340187244
Energy: 1.3446330217044407
Energy: 1.351521614909119
Energy: 1.3643390359103678
Energy: 1.4282314306962922
Energy: 1.4201271521774559
Energy: 1.364217051639913
Energy: 1.364155316263504
Energy: 1.267903307290972
Energy: 1.3650233585408438
Energy: 1.3636680700988602
Energy: 1.2683884335740692
Energy: 1.3629901501049246
Energy: 1.3648056386154461
Energy: 1.3418765031931033
Energy: 1.362928175231955
Energy: 1.3635719290534292
Energy: 1.3531121222497637
Energy: 1.3634742795748414
Energy: 1.447929321985665
Energy: 1.3410601426634186
Energy: 1.365574600828774
Energy: 1.3678206834098918
Energy: 1.3463752096521302
Energy: 1.367187212107029
Energy: 1.4473355398131995
Energy: 1.2689292059248762
Energy: 1.3651807550358117
Energy: 1.4111172239182121
Energy: 1.2811583520430343
Energy: 1.4461738053962865
Energy: 1.3664586974897224
Energy: 1.3510210892380967
Energy: 1.4489228537941405
Energy: 1.4469583293551176
Energy: 1.4465410684048547
Energy: 1.4473063795805123
Energy: 1.4806010046313547
Energy: 1.3509130540293288
Energy: 1.4472764233109168
Energy: 1.477968416316716
Energy: 1.3462090519146315
Energy: 1.4471745983078061
Energy: 1.482392912776643
Energy: 1.268175699523171
Energy: 1.4477615521930196
Energy: 1.2812854920575918
Energy: 1.282223711032129
Energy: 1.445979397740972
Energy: 1.3653525027302367
Energy: 1.351191609293772
Energy: 1.447577452768566
Energy: 1.4503970875104195
Energy: 1.4504414551969638
Energy: 1.4458227626951412
Energy: 1.4464711264707404
Energy: 1.2682742175830488
Energy: 1.4489837814087994
Energy: 1.4492409145256646
Energy: 1.2669130125732826
Energy: 1.4486449710671043
Energy: 1.3693302181907558
Energy: 1.356407194095346
Energy: 1.452654942937206
Energy: 1.3646948361923248
Energy: 1.351174053221649
Energy: 1.3656752901694935
Energy: 1.4481903875476525

minimum gb energy = 1.2641920763309222 eV
minimum distance =  2.24197962958758 Angstroms
sigma value = 33


========================================
theta = 22.84350731792459
========================================

Energy: 2.5208800419280797
Energy: 1.4633996319440103
Energy: 1.4172490773293926
Energy: 1.3848217825942128
Energy: 1.4171898507555878
Energy: 1.523238045645991
Energy: 1.5883224470548913
Energy: 1.490033509505846
Energy: 1.4001703681307809
Energy: 1.3756440719761942
Energy: 1.3999765541810558
Energy: 1.4899778345623265
Energy: 1.5314106503133662
Energy: 1.4909565651578633
Energy: 1.4909787044443854
Energy: 1.3642499469371208
Energy: 1.4906521862678628
Energy: 1.4899432844682303
Energy: 1.4690961257525987
Energy: 1.4901109967335802
Energy: 1.4892257322862401
Energy: 1.4917340418190843
Energy: 1.489320788232117
Energy: 1.472067776898099
Energy: 1.522658052879482
Energy: 1.4897796615860053
Energy: 1.4473773257922178
Energy: 1.5125662086379128
Energy: 1.526087224402484
Energy: 1.475343312146085
Energy: 1.3794252412393835
Energy: 1.5305386962276435
Energy: 1.5314624174927534
Energy: 1.3754199078862603
Energy: 1.5319545308922085
Energy: 1.5302124993478905
Energy: 1.3765509393987674
Energy: 1.5311525416544212
Energy: 1.5306663970802252
Energy: 1.6386057380477352
Energy: 1.531176121907128
Energy: 1.530656634093111
Energy: 1.37574806949463
Energy: 1.4073408555663982
Energy: 1.3989784957441918
Energy: 1.3759518641199813
Energy: 1.5318424278987735
Energy: 1.4073783348984121
Energy: 1.4022219284192285
Energy: 1.4905249064356116
Energy: 1.4917971311067852
Energy: 1.4717684028960132
Energy: 1.4903497553160832
Energy: 1.5631371271057781
Energy: 1.3241936123104678
Energy: 1.489499745672198
Energy: 1.491085844339238
Energy: 1.4710797228550183
Energy: 1.489689791391208
Energy: 1.513772558733129
Energy: 1.4093056169082827
Energy: 1.397909659458985
Energy: 1.4912352923812175
Energy: 1.485148204213314
Energy: 1.4893633057644937
Energy: 1.3979748781533161
Energy: 1.3759007306486957
Energy: 1.3981489580155166
Energy: 1.398377822939113
Energy: 1.3634582295030757
Energy: 1.3979916143801885
Energy: 1.3983177757194922
Energy: 1.3640551090255224
Energy: 1.3980905782366317
Energy: 1.3989201681796617
Energy: 1.3622291513678209
Energy: 1.398088999726011
Energy: 1.3979654973177054
Energy: 1.3789528038713756
Energy: 1.3383766049408312
Energy: 1.491412144490875
Energy: 1.485147140604213
Energy: 1.4896625386220474
Energy: 1.3752478924244638
Energy: 1.3724383785831409
Energy: 1.5227453789431127
Energy: 1.5244250521222593
Energy: 1.4707244352959206
Energy: 1.5245005264244977
Energy: 1.5224627658870349
Energy: 1.365896549516783
Energy: 1.5239186751151648
Energy: 1.5426422733128045
Energy: 1.4706233548247187
Energy: 1.52671486845098
Energy: 1.5924643746127418
Energy: 1.3658922209079853
Energy: 1.3394704436117344
Energy: 1.531364561778252
Energy: 1.529068877071643
Energy: 1.5248385903954154
Energy: 1.338984403418623
Energy: 1.3309545696852059
Energy: 1.522451340206631
Energy: 1.5228135855851117
Energy: 1.6082365722125536
Energy: 1.523377538752616
Energy: 1.5274197769068203
Energy: 1.327416197627071
Energy: 1.522890881640437
Energy: 1.5233136179930789
Energy: 1.5149653073441232
Energy: 1.5243290247985253
Energy: 1.5227723025146636
Energy: 1.376824262709941
Energy: 1.3984936400136818
Energy: 1.4902887720650273
Energy: 1.5144993901394117
Energy: 1.4892877333389092
Energy: 1.3781322806182996
Energy: 1.365795947876157
Energy: 1.399029857937074
Energy: 1.4550065107618444
Energy: 1.5691778353368437
Energy: 1.398729409783073
Energy: 1.3657888052775449
Energy: 1.3750946755553197
Energy: 1.3995010689775935
Energy: 1.707841391751634
Energy: 1.3713743180219464
Energy: 1.3989997616904297
Energy: 1.3989107992575973
Energy: 1.511647319277986
Energy: 1.713715757386561
Energy: 1.4965742681899499
Energy: 1.4842426798514499
Energy: 1.4967301254642464
Energy: 1.4456672750449913
Energy: 1.3348201879077672
Energy: 1.492307039555968
Energy: 1.4908717400020415
Energy: 1.4718315717550592
Energy: 1.4927186931581289
Energy: 1.527475077873036
Energy: 1.5139901579366772
Energy: 1.5297044986640986
Energy: 1.4904177244688088
Energy: 1.4721721291115257
Energy: 1.4933062108713204
Energy: 1.4458106270565252
Energy: 1.374846930859955
Energy: 1.5306857119539232
Energy: 1.5305435862705894
Energy: 1.3762688197805897
Energy: 1.5307141477352793
Energy: 1.3990694956296106
Energy: 1.3999056263779583
Energy: 1.5304483977830612
Energy: 1.5303911943446296
Energy: 1.5121728063064492
Energy: 1.530756537406721
Energy: 1.5306684693575954
Energy: 1.376939771752913
Energy: 1.5312786347804326
Energy: 1.3995264339305402
Energy: 1.375373102215521
Energy: 1.5317681635817233
Energy: 1.3985024875395433
Energy: 1.4713627665502422
Energy: 1.4928712976554617
Energy: 1.5603748838803657
Energy: 1.403541314071068
Energy: 1.4933928632201792
Energy: 1.4916883619700005
Energy: 1.4702896998204888
Energy: 1.4925934706316495
Energy: 1.5155638047255124
Energy: 1.5309666053394284
Energy: 1.49180500748294
Energy: 1.49917239117106
Energy: 1.4853708613672345
Energy: 1.4916065596812602
Energy: 1.4461140797749379
Energy: 1.4611265401005655
Energy: 1.4916560923353746
Energy: 1.4906593093605633
Energy: 1.4685965146222826
Energy: 1.3996169921137542
Energy: 1.3987336501569527
Energy: 1.375686981808641
Energy: 1.3984216420077418
Energy: 1.5411132907514151
Energy: 1.3613951388721932
Energy: 1.398112581171711
Energy: 1.3981902046317347
Energy: 1.3649711925899313
Energy: 1.3980573354237749
Energy: 1.4894981903165414
Energy: 1.5257101845695176
Energy: 1.4892860642414782
Energy: 1.3980488743467236
Energy: 1.3750197615950592
Energy: 1.398558947424314
Energy: 1.491272975857358
Energy: 1.5140708784994992
Energy: 1.5236276109229188
Energy: 1.522468146330266
Energy: 1.3732188234989344
Energy: 1.5226708376769003
Energy: 1.5010501086062495
Energy: 1.470758218528796
Energy: 1.523419268180129
Energy: 1.5225993659167631
Energy: 1.3676040687837925
Energy: 1.5227986410223766
Energy: 1.5411083042541422
Energy: 1.4830717267422016
Energy: 1.4786158582071176
Energy: 1.3378792941641064
Energy: 1.3308591184734828
Energy: 1.3658618866852035
Energy: 1.4803019767337118
Energy: 1.47042438189263
Energy: 1.5250741527324334
Energy: 1.5230655246786347
Energy: 1.3290790247351176
Energy: 1.5231687279250103
Energy: 1.5889465274530046
Energy: 1.5150527452927063
Energy: 1.5238331201522393
Energy: 1.522403374454659
Energy: 1.3267135336383777
Energy: 1.5227411756601674
Energy: 1.5229703018572742
Energy: 1.5270366034006446
Energy: 1.489499797362932
Energy: 1.3768569459849835
Energy: 1.377323119041649
Energy: 1.4002517995666897
Energy: 1.490192646504893
Energy: 1.4007298050928358
Energy: 1.3983168049531336
Energy: 1.3987784934517111
Energy: 1.366334162533236
Energy: 1.3985538640830495
Energy: 1.5159465282415174

minimum gb energy = 1.3241936123104678 eV
minimum distance =  2.23954021109659 Angstroms
sigma value = 51


========================================
theta = 26.525352016609688
========================================

Energy: 2.37903116404636
Energy: 1.5642220968612002
Energy: 1.5095483963597218
Energy: 1.4937275280261884
Energy: 1.4822448329881948
Energy: 1.5644274419177615
Energy: 1.3422786456008906
Energy: 1.5756361621802288
Energy: 1.4813325388826897
Energy: 1.5055728257536622
Energy: 1.4825025185624512
Energy: 1.4937377718870954
Energy: 1.5059605593985625
Energy: 1.4820617750303107
Energy: 1.576120092897508
Energy: 1.493542606598784
Energy: 1.4815240678695578
Energy: 1.4820694720468537
Energy: 1.4899597164073748
Energy: 1.4819588309183356
Energy: 1.480694948991163
Energy: 1.4952619691584685
Energy: 1.4810488505371584
Energy: 1.4820519246599826
Energy: 1.504115680524198
Energy: 1.494323735199115
Energy: 1.4852610710745806
Energy: 1.493093706802364
Energy: 1.5658624414938318
Energy: 1.495746769064957
Energy: 1.5200957484209807
Energy: 1.5709497583221945
Energy: 1.4816373661997373
Energy: 1.5074042999652846
Energy: 1.5685489996385178
Energy: 1.5685875129637128
Energy: 1.5057119862138164
Energy: 1.5700107565143604
Energy: 1.5691252481634024
Energy: 1.6281249962954878
Energy: 1.571375969243269
Energy: 1.5685604846070746
Energy: 1.5254140287199718
Energy: 1.491368500320511
Energy: 1.481009052439773
Energy: 1.5077474899414156
Energy: 1.568424227729268
Energy: 1.4819595349942527
Energy: 1.3435370780605922
Energy: 1.4844823085152539
Energy: 1.4819040603789735
Energy: 1.4937729047797583
Energy: 1.4810641889214102
Energy: 1.5557371102469724
Energy: 1.3403540757338404
Energy: 1.4809763030044192
Energy: 1.4818429252025114
Energy: 1.5069892796288635
Energy: 1.4817800718315615
Energy: 1.5541699685816732
Energy: 1.4922724037621877
Energy: 1.494371802907792
Energy: 1.4837502792136115
Energy: 1.4966536483052246
Energy: 1.4854209413563733
Energy: 1.4813462522485934
Energy: 1.5060045599235474
Energy: 1.4810519980215566
Energy: 1.4802977056260211
Energy: 1.5099002978272915
Energy: 1.4804050147591432
Energy: 1.480841698939388
Energy: 1.4871796986623504
Energy: 1.4811927857814648
Energy: 1.4806168909543038
Energy: 1.5098297361576798
Energy: 1.4805513685489256
Energy: 1.4810614001959996
Energy: 1.506684803412668
Energy: 1.4852061047704774
Energy: 1.4852317153733392
Energy: 1.4931161622957663
Energy: 1.485642419614804
Energy: 1.480636833492423
Energy: 1.5191124918000236
Energy: 1.5671261918798567
Energy: 1.5673520748813332
Energy: 1.6319684024711023
Energy: 1.5669232531178705
Energy: 1.5669065801706306
Energy: 1.5046969063663576
Energy: 1.566967807698013
Energy: 1.5675699457528776
Energy: 1.6317667286968915
Energy: 1.5673052808741261
Energy: 1.5673130334305934
Energy: 1.492992076997234
Energy: 1.4850403406702164
Energy: 1.4935165421502783
Energy: 1.5066280669902439
Energy: 1.485523748900661
Energy: 1.4849587974712604
Energy: 1.3398712175669816
Energy: 1.4808665425364222
Energy: 1.480823070342067
Energy: 1.488307871987686
Energy: 1.481892709018307
Energy: 1.5540216892633807

minimum gb energy = 1.3398712175669816 eV
minimum distance =  2.245984786436 Angstroms
sigma value = 19


========================================
theta = 31.586338096527925
========================================

Energy: 2.1937528242738615
Energy: 1.6182376740100495
Energy: 1.520773332713391
Energy: 1.4839476543441341
Energy: 1.5201252000421823
Energy: 1.618255566305622
Energy: 1.404479773616291
Energy: 1.6456360488032604
Energy: 1.519904679638161
Energy: 1.4727372262012524
Energy: 1.519700622963311
Energy: 1.6325813797132145
Energy: 1.5406771319619608
Energy: 1.6304523245962834
Energy: 1.6307597980537347
Energy: 1.4748977474151486
Energy: 1.6296524651849362
Energy: 1.6293723394793027
Energy: 1.6709316285650953
Energy: 1.6305960785217786
Energy: 1.6295999047497582
Energy: 1.6204199565849493
Energy: 1.6300557705308272
Energy: 1.6306318337319277
Energy: 1.4827038795467846
Energy: 1.6458697083996494
Energy: 1.6210445378923597
Energy: 1.4743230579640454
Energy: 1.6485718143444243
Energy: 1.6306105112076297
Energy: 1.6712671928353937
Energy: 1.6294634916762567
Energy: 1.6006075527361405
Energy: 1.4719953697295836
Energy: 1.6304423675429176
Energy: 1.6750351188986305
Energy: 1.5073386233137482
Energy: 1.6293736791765794
Energy: 1.653616074987524
Energy: 1.6431516653056746
Energy: 1.6437444757068864
Energy: 1.629610009984465
Energy: 1.5069000443884597
Energy: 1.62918631458545
Energy: 1.582983489614252
Energy: 1.4767420510688496
Energy: 1.631406747452879
Energy: 1.629771657161012
Energy: 1.4658647557434643
Energy: 1.5207326659608558
Energy: 1.5196075521793186
Energy: 1.4715517623959493
Energy: 1.5192302278625502
Energy: 1.6294755172143445
Energy: 1.4663073532187414
Energy: 1.5189133879929526
Energy: 1.519951242189419
Energy: 1.4843913400354314
Energy: 1.5199518732836406
Energy: 1.6317360253797308
Energy: 1.4848852289781662
Energy: 1.6438317549513164
Energy: 1.5397149605397091
Energy: 1.5421948308112226
Energy: 1.5193664774620246
Energy: 1.5730844438398932
Energy: 1.5070412017148727
Energy: 1.647094968787618
Energy: 1.6488785322706778
Energy: 1.6348107421507956
Energy: 1.6472547358451843
Energy: 1.629726444560189
Energy: 1.7582560848370876
Energy: 1.649905255661203
Energy: 1.6485886749173992
Energy: 1.6348388762241823
Energy: 1.6494578227439762
Energy: 1.7068111817067506
Energy: 1.5416794996182832
Energy: 1.6466052412315906
Energy: 1.634169542235135
Energy: 1.5391206739098375
Energy: 1.6309784680538264
Energy: 1.5942338354891685
Energy: 1.4845684342810455
Energy: 1.5194605378507422
Energy: 1.6493313444618365
Energy: 1.4049311175414196
Energy: 1.5190408720222488
Energy: 1.4856799496520992
Energy: 1.4705569767167723
Energy: 1.5196543154588806
Energy: 1.5983375157910538
Energy: 1.523872092155978
Energy: 1.5191584229035189
Energy: 1.5204684226492373
Energy: 1.4761447934414755
Energy: 1.5197853121080989
Energy: 1.6439146863318483
Energy: 1.4854183815349524
Energy: 1.6445435588065218
Energy: 1.520360612276248
Energy: 1.5585863192711393
Energy: 1.6290923855402746
Energy: 1.629941486950779
Energy: 1.693589524002582
Energy: 1.629707098367627
Energy: 1.629574894948131
Energy: 1.6197874633867215
Energy: 1.6292114456861633
Energy: 1.6295932615299085
Energy: 1.669260541311843
Energy: 1.6291236902866384
Energy: 1.63045014704962
Energy: 1.4321424284428752
Energy: 1.6200195606475403
Energy: 1.6307500554585213
Energy: 1.5411037642468153
Energy: 1.6300485198525358
Energy: 1.4311685481259802
Energy: 1.5280947518995969
Energy: 1.629921188246773
Energy: 1.6659315426595827
Energy: 1.6703762257884656
Energy: 1.6295363309772974
Energy: 1.6486573427105666
Energy: 1.5285867886443705
Energy: 1.629856831924229
Energy: 1.6308227731263787
Energy: 1.7016078727288797
Energy: 1.6308991743076124
Energy: 1.641765478830299
Energy: 1.4317599080707613
Energy: 1.5188661323484327
Energy: 1.6294760553656709
Energy: 1.4857094094346333
Energy: 1.6296200797738856
Energy: 1.5205295396870573
Energy: 1.4711282984266858
Energy: 1.5194544011982567
Energy: 1.6313190248154135
Energy: 1.4657156827967956
Energy: 1.5184114060754121
Energy: 1.5191122685834855
Energy: 1.4827499541999165
Energy: 1.5193010551882085
Energy: 1.5198028076646657
Energy: 1.4658540053000961
Energy: 1.5185840807739224
Energy: 1.519674767912532
Energy: 1.5071954675714858
Energy: 1.5823462526086258
Energy: 1.629157737583308
Energy: 1.4852487370048493
Energy: 1.6298157965923907
Energy: 1.5816573307880688
Energy: 1.4844529575351721
Energy: 1.6471779807887001
Energy: 1.647379034445978
Energy: 1.5067599449519338
Energy: 1.6478027708323681
Energy: 1.6469349044614692
Energy: 1.54138362478254
Energy: 1.6469410828790036
Energy: 1.6484544180166893
Energy: 1.7776131248333213
Energy: 1.646825104913176
Energy: 1.633399663051401
Energy: 1.5315575262659242
Energy: 1.6430541504979912
Energy: 1.5840837248132238
Energy: 1.535997997497533
Energy: 1.6209291630903506
Energy: 1.586139184954732
Energy: 1.3995925071386786
Energy: 1.519192292916773
Energy: 1.51976402294775
Energy: 1.4859480747104021
Energy: 1.5198413913491402
Energy: 1.5987594158308844

minimum gb energy = 1.3995925071386786 eV
minimum distance =  2.22522426950818 Angstroms
sigma value = 27


========================================
theta = 38.94244126898138
========================================

Energy: 2.1754962291630995
Energy: 1.642958003828741
Energy: 1.7112309740700027
Energy: 1.5093790763082542
Energy: 1.7102804111538148
Energy: 1.5856468518135696
Energy: 1.503803235658839
Energy: 1.6892786621063083
Energy: 1.509391522830985
Energy: 1.5084398347460846
Energy: 1.691618550020401
Energy: 1.688985987137732
Energy: 1.8586259332658843
Energy: 1.6885983437512682
Energy: 1.6872966953157276
Energy: 1.3222389561729593
Energy: 1.687795334914625
Energy: 1.6890349890383558
Energy: 1.4804750444060852
Energy: 1.678921654625006
Energy: 1.6873167402361948
Energy: 1.3222272791658543
Energy: 1.6879762412211659
Energy: 1.6763595840165384
Energy: 1.851377766216674
Energy: 1.6794435004527346
Energy: 1.5135858692279947
Energy: 1.3226661145457563
Energy: 1.5127317423574231
Energy: 1.680291358148637
Energy: 1.8055715337781841
Energy: 1.593567253598403
Energy: 1.3216986242780022
Energy: 1.3229436322600747
Energy: 1.5944723929501643
Energy: 1.5134194157607765
Energy: 1.7305001111065221
Energy: 1.5935186966799402
Energy: 1.593628330028073
Energy: 1.8258895574144158
Energy: 1.5934833932834536
Energy: 1.5142043744994873
Energy: 1.7323429573155382
Energy: 1.594605806570059
Energy: 1.3223039194052288
Energy: 1.3231090747089536
Energy: 1.5946923813532685
Energy: 1.5156074251427276
Energy: 1.8422947956382416
Energy: 1.6707595305340908
Energy: 1.3215702882103626
Energy: 1.3219802251673456
Energy: 1.3213087991563894
Energy: 1.778018247839396
Energy: 1.505503587761026
Energy: 1.672386303460247
Energy: 1.675119112488335
Energy: 1.3487666768802036
Energy: 1.677853639665646
Energy: 1.6707909651600936
Energy: 1.8595529340810075
Energy: 1.778504580103254
Energy: 1.6824736702841285
Energy: 1.3466663182395915
Energy: 1.6836664868712021
Energy: 1.6901766241181124
Energy: 1.5039055512164843
Energy: 1.7789001856511206
Energy: 1.6942151207997986
Energy: 1.5570281086725077
Energy: 1.6920693759649086
Energy: 1.6884580274999614

minimum gb energy = 1.3213087991563894 eV
minimum distance =  2.26580514171801 Angstroms
sigma value = 9


========================================
theta = 44.00342734889962
========================================

Energy: 1.5546050769668118
Energy: 1.604140321929432
Energy: 1.4275048452308965
Energy: 1.4296188230247895
Energy: 1.4978156874867898
Energy: 1.6875908832720286
Energy: 1.5306359576379764
Energy: 1.6765045173339723
Energy: 1.4965575401069047
Energy: 1.4544138508925397
Energy: 1.4962912841860956
Energy: 1.5635956659072459
Energy: 1.5275133591317305
Energy: 1.7554240189480457
Energy: 1.7510700372412928
Energy: 1.4965384180079941
Energy: 1.738177112891215
Energy: 1.4969244448681773
Energy: 1.3968552574281436
Energy: 1.751511974145972
Energy: 1.7503315955573293
Energy: 1.4280258793454619
Energy: 1.73730512655396
Energy: 1.7552977954899127
Energy: 1.4537864187436589
Energy: 1.748960251052851
Energy: 1.587201181820309
Energy: 1.519062460534374
Energy: 1.7374614067286012
Energy: 1.6173746478916478
Energy: 1.4532043680502875
Energy: 1.4961318692110168
Energy: 1.7357995158523687
Energy: 1.5279464521801918
Energy: 1.4973386013004244
Energy: 1.4961237144310586
Energy: 1.4272878628738384
Energy: 1.4961318059905038
Energy: 1.649723228441301
Energy: 1.7283010103255452
Energy: 1.4963717151954437
Energy: 1.4265861127040917
Energy: 1.4261264989387097
Energy: 1.496140246908447
Energy: 1.7247989648938788
Energy: 1.5273788925160412
Energy: 1.496878098208975
Energy: 1.4270901475828548
Energy: 1.4271125548011294
Energy: 1.7203310698544225
Energy: 1.7160719129304425
Energy: 1.525351857742114
Energy: 1.707352086522418
Energy: 1.4270747889786286
Energy: 1.427617276221625
Energy: 1.7157953794960583
Energy: 1.7040633068050939
Energy: 1.4533977407054377
Energy: 1.706244570633771
Energy: 1.5736017367545505
Energy: 1.5345878377685158
Energy: 1.7224526974666305
Energy: 1.7048461015988876
Energy: 1.582571397154909
Energy: 1.704268363482983
Energy: 1.4665914693768136
Energy: 1.4666718178647005
Energy: 1.670326831154451
Energy: 1.6305948647643476
Energy: 1.526984055501924
Energy: 1.6302283842846648
Energy: 1.6194971339114534
Energy: 1.450032018302718
Energy: 1.630677097570775
Energy: 1.5808086125426526
Energy: 1.4889736471016972
Energy: 1.6306805080233564
Energy: 1.7094510442542614
Energy: 1.467017190289285
Energy: 1.631311164924438
Energy: 1.5800038114978732
Energy: 1.4917155187048918
Energy: 1.630052003388326
Energy: 1.6179041328181327
Energy: 1.5337972993896432
Energy: 1.6976755400417434
Energy: 1.4921022827578136
Energy: 1.4908342428877157
Energy: 1.6324983047370236
Energy: 1.6203689976393787
Energy: 1.4463331197576772
Energy: 1.6298246727857149
Energy: 1.6290415643974063
Energy: 1.4976667421923842
Energy: 1.6310783385794547
Energy: 1.6685039829659263
Energy: 1.3960404455251683
Energy: 1.6290888676481456
Energy: 1.6311065077240579
Energy: 1.5243275604849607
Energy: 1.629620009528912
Energy: 1.6678130995119511
Energy: 1.5320120573006513
Energy: 1.7054776301321457
Energy: 1.6307478752199274
Energy: 1.4984478715975014
Energy: 1.7043389579011994
Energy: 1.5338623876871993
Energy: 1.4270080767579811
Energy: 1.7259935638745256
Energy: 1.7094375871802054
Energy: 1.6246303608000048
Energy: 1.7108063309428683
Energy: 1.4272803643869483
Energy: 1.4304146171961005
Energy: 1.720095798202615
Energy: 1.7224735877209083
Energy: 1.497775717288352
Energy: 1.7049281104966096
Energy: 1.6447319042611765
Energy: 1.4298362516973235
Energy: 1.428596364841764
Energy: 1.7113730481704115
Energy: 1.584471000632818
Energy: 1.636811421124966
Energy: 1.429432345251327
Energy: 1.4287457288798293
Energy: 1.4977292212879256
Energy: 1.582791788908876
Energy: 1.3920776297731445
Energy: 1.4961498615785247
Energy: 1.4278932598054757
Energy: 1.4516982834833712
Energy: 1.4961863606068213
Energy: 1.6656990659301323
Energy: 1.3915859083626856
Energy: 1.495617659499667
Energy: 1.4960077137590213
Energy: 1.4563275384548071
Energy: 1.5863413398782709
Energy: 1.7584411656226222
Energy: 1.5633185339106463
Energy: 1.7368295801602636
Energy: 1.498120049426403
Energy: 1.450933770481239
Energy: 1.7356113778881026
Energy: 1.7543643287776292
Energy: 1.4966701181696975
Energy: 1.7503841967455924
Energy: 1.7512580742926065
Energy: 1.4550700610415275
Energy: 1.7349881438906205
Energy: 1.751253775769916
Energy: 1.3967301585093401
Energy: 1.752445468129263
Energy: 1.586808363975784
Energy: 1.5239285396815032
Energy: 1.739095955459102
Energy: 1.4977465842050055
Energy: 1.4565782645193561
Energy: 1.4975564176609253
Energy: 1.563808027245088
Energy: 1.4425863001747414
Energy: 1.4965413407697277
Energy: 1.4975006275875444
Energy: 1.4549148710063888
Energy: 1.4967294752726412
Energy: 1.6300768127621965
Energy: 1.4614321613752341
Energy: 1.4950450256012582
Energy: 1.4959237574182
Energy: 1.4234655308686148
Energy: 1.4959064915810876
Energy: 1.6289704536157172
Energy: 1.5294267415538827
Energy: 1.7095926436686084
Energy: 1.430944981789816
Energy: 1.4279977982686556
Energy: 1.5728776136942149
Energy: 1.5629333824602374
Energy: 1.4496223932919237
Energy: 1.704054524347928
Energy: 1.7134247965561478
Energy: 1.6649841121743925
Energy: 1.7138621992585468
Energy: 1.715517278795721
Energy: 1.4508067508695373
Energy: 1.706490250940824
Energy: 1.5531397670807647
Energy: 1.460489767317909
Energy: 1.7200581459888133
Energy: 1.7370067216766727
Energy: 1.5277360893010283
Energy: 1.63175655312569
Energy: 1.709874874991469
Energy: 1.5337636765305045
Energy: 1.7079500289601899
Energy: 1.5637973188234278
Energy: 1.5192871350731896
Energy: 1.6310533936852842
Energy: 1.6306202588124936
Energy: 1.4221930143544248
Energy: 1.6303252755355249
Energy: 1.675192060429545
Energy: 1.5167928213448745
Energy: 1.6297011048471093
Energy: 1.6286793385434022
Energy: 1.49283584202545
Energy: 1.6295049783914834
Energy: 1.5678363158586743
Energy: 1.487186628087338
Energy: 1.5808682816092408
Energy: 1.6701788940622773
Energy: 1.5336965566085499
Energy: 1.697277464302427
Energy: 1.4900589360807361
Energy: 1.5166018013121687
Energy: 1.6295565741007578
Energy: 1.6322061431593686
Energy: 1.3958572159071032
Energy: 1.6289156995019372
Energy: 1.5673468764485492
Energy: 1.5177204004807523
Energy: 1.6313862067653437
Energy: 1.6693916253125745
Energy: 1.449102062465477
Energy: 1.6307611426621156
Energy: 1.52861368966812
Energy: 1.528119703981503
Energy: 1.6311857926858
Energy: 1.7090756802306235
Energy: 1.5340474532239157
Energy: 1.7080632201752208
Energy: 1.5640340833121025
Energy: 1.4465097562577878
Energy: 1.7058483066183456
Energy: 1.7405465377234255
Energy: 1.4612473651244666
Energy: 1.7087388548418954
Energy: 1.7043158371226947
Energy: 1.4561425432603643
Energy: 1.7038861772485487
Energy: 1.7145815484913196
Energy: 1.4268790992318081
Energy: 1.7047307082771084
Energy: 1.7036989689075246
Energy: 1.5249513116728903
Energy: 1.7120954951919711
Energy: 1.428687752187581
Energy: 1.4283508966146266
Energy: 1.7234888098382233
Energy: 1.5631232162872601
Energy: 1.3907868416337845
Energy: 1.4960672931611232
Energy: 1.4261515691886208
Energy: 1.422634316866623
Energy: 1.495917050981664
Energy: 1.58232963107885

minimum gb energy = 1.3907868416337845 eV
minimum distance =  2.19419029978936 Angstroms
sigma value = 57


========================================
theta = 50.47880364135782
========================================

Energy: 2.441824566929888
Energy: 1.6627168162164951
Energy: 1.3113463805646899
Energy: 1.3112887915384075
Energy: 1.561691169024625
Energy: 1.662658132048136
Energy: 1.2708420313336721
Energy: 1.6644846030840952
Energy: 1.4970953865583034
Energy: 1.2771045065512703
Energy: 1.4976070770852252
Energy: 1.6678742803464248
Energy: 1.2795996236813598
Energy: 1.6771259028311833
Energy: 1.673261165464718
Energy: 1.2790859954923743
Energy: 1.6759571347861617
Energy: 1.500467077766614
Energy: 1.2729245448609408
Energy: 1.539099321075576
Energy: 1.6751717822086565
Energy: 1.2789205114488915
Energy: 1.6775382501522713
Energy: 1.2717904862208576
Energy: 1.2742838729895187
Energy: 1.5384518465677317
Energy: 1.676498665015886
Energy: 1.2798865214040749
Energy: 1.6774121856603414
Energy: 1.5383087800528719
Energy: 1.2761376757185874
Energy: 1.497577155809312
Energy: 1.674948268084551
Energy: 1.2792486936077778
Energy: 1.4973504907762651
Energy: 1.4963171161858109
Energy: 1.3119875451363017
Energy: 1.5054999215848557
Energy: 1.5051123982154166
Energy: 1.2658558456993378
Energy: 1.505686864256449
Energy: 1.312345352496883
Energy: 1.3132869960845597
Energy: 1.4979370027001253
Energy: 1.6680428194904808
Energy: 1.2807743423119005
Energy: 1.4979005827698941
Energy: 1.4979629964070187
Energy: 1.312094571700975
Energy: 1.3123698006574274
Energy: 1.676604380592846
Energy: 1.2815949094682482
Energy: 1.6684187342207712
Energy: 1.312779251681338
Energy: 1.3127516194700057
Energy: 1.3140515725600346
Energy: 1.664896455853098
Energy: 1.271873245150013
Energy: 1.4993684303042458
Energy: 1.3128754031974925
Energy: 1.2789565748068459
Energy: 1.5006923530920488
Energy: 1.6627937196831497
Energy: 1.2708324202652743
Energy: 1.4975770078586965
Energy: 1.2796289666115752
Energy: 1.280511214438993
Energy: 1.6721071249256403
Energy: 1.6632773833450514
Energy: 1.2790641573577766
Energy: 1.6723851843017594
Energy: 1.503342528210904
Energy: 1.2776834040478713
Energy: 1.6729888890354518
Energy: 1.5404555105144586
Energy: 1.2791330647976311
Energy: 1.6728199046158774
Energy: 1.676631926616942
Energy: 1.2802032291963046
Energy: 1.6726451436156546
Energy: 1.5382848956156883
Energy: 1.2727306281658677
Energy: 1.6740989418698218
Energy: 1.539395677061519
Energy: 1.2810231315352836
Energy: 1.6734577191123312
Energy: 1.5021302884306533
Energy: 1.2802740171900073
Energy: 1.5017583531638001
Energy: 1.6640626614868763
Energy: 1.265751929604576
Energy: 1.4999572366912077
Energy: 1.5040588755476454
Energy: 1.2792729275296466
Energy: 1.5033583150046494
Energy: 1.5352154734528962
Energy: 1.26571863333262
Energy: 1.4972155100096034
Energy: 1.4986370123445465
Energy: 1.313077289078382
Energy: 1.4980349026177593
Energy: 1.6630023374398641
Energy: 1.278659961631593
Energy: 1.6614934132127306
Energy: 1.3122085707408073
Energy: 1.309421390214261
Energy: 1.5054116498123873
Energy: 1.6631452784134222
Energy: 1.2701961806522224
Energy: 1.6627712382343867
Energy: 1.3134265887086682
Energy: 1.3117807768839091
Energy: 1.4979096517940562
Energy: 1.6720867263829613

minimum gb energy = 1.26571863333262 eV
minimum distance =  2.21422063440553 Angstroms
sigma value = 11


========================================
theta = 55.8767054592047
========================================

Energy: 1.7572349862788295
Energy: 1.172727813933819
Energy: 1.1902737194277886
Energy: 1.252795599483811
Energy: 1.1864481071627855
Energy: 1.1710136900039192
Energy: 1.1695329579388165
Energy: 1.3579809249499382
Energy: 1.1852085214492116
Energy: 1.1642754632054706
Energy: 1.3567514016149878
Energy: 1.6086432185976725
Energy: 1.1666232876803972
Energy: 1.5740187198668008
Energy: 1.421586539611917
Energy: 1.1665090427298495
Energy: 1.5753078548213606
Energy: 1.6081369848551446
Energy: 1.1675145183634548
Energy: 1.5755724524816404
Energy: 1.4200788283858912
Energy: 1.1665554333717054
Energy: 1.575041057163727
Energy: 1.6095787114686115
Energy: 1.165818625299635
Energy: 1.5742577174579597
Energy: 1.4229740990403459
Energy: 1.1657407251903726
Energy: 1.5747628691147988
Energy: 1.608540259106501
Energy: 1.1648649773999116
Energy: 1.5729825746382837
Energy: 1.430279323136893
Energy: 1.1682314227933714
Energy: 1.5728008380827116
Energy: 1.417347865560173
Energy: 1.1675309390231234
Energy: 1.4179784968329854
Energy: 1.4192589795645498
Energy: 1.1560912132101635
Energy: 1.4191801576024274
Energy: 1.419661603693431
Energy: 1.1612764730026621
Energy: 1.5734736829372231
Energy: 1.5734356496571318
Energy: 1.1835798496597039
Energy: 1.5738311200982005
Energy: 1.4369098745806803
Energy: 1.166465518012583
Energy: 1.3577314692978193
Energy: 1.6088809321484994
Energy: 1.1674325276361346
Energy: 1.4172717415186902
Energy: 1.1804648553210937
Energy: 1.1655849380317687
Energy: 1.1839198579692047
Energy: 1.357462258753615
Energy: 1.1769433349098988
Energy: 1.357855949407011
Energy: 1.164554180789159
Energy: 1.1834920338258934
Energy: 1.3581871722307446
Energy: 1.3563126526048828
Energy: 1.1611187998839654
Energy: 1.3567571338776014
Energy: 1.1824999026103882
Energy: 1.1769312496661253
Energy: 1.1816704987130526
Energy: 1.606660714275323
Energy: 1.3736926404029457
Energy: 1.1831254853990516
Energy: 1.1820553115378603
Energy: 1.1844878013756128
Energy: 1.3583158041102983
Energy: 1.5721121823554336
Energy: 1.1629376522999197
Energy: 1.3569583007373112
Energy: 1.1856682169511832
Energy: 1.1663900419289608
Energy: 1.1649945070393688
Energy: 1.1601199012069119
Energy: 1.1551205358347711
Energy: 1.1824563921421143
Energy: 1.1664206731594566
Energy: 1.1654533888338638
Energy: 1.359467297137863
Energy: 1.610772809095254
Energy: 1.1828712153787975
Energy: 1.1835584901680503
Energy: 1.1845989524460636
Energy: 1.1666938642994895
Energy: 1.576101430950987
Energy: 1.609000776639066
Energy: 1.420185944947066
Energy: 1.5748540280217072
Energy: 1.416801762068736
Energy: 1.1701241023326603
Energy: 1.4186416225696472
Energy: 1.6107630357218283
Energy: 1.1634067740174077
Energy: 1.4232618448954077
Energy: 1.4218914620471794
Energy: 1.1643452329134476
Energy: 1.5745381901259057
Energy: 1.5727261601666191
Energy: 1.1673662179770639
Energy: 1.573443851630271
Energy: 1.5771114154259365
Energy: 1.166812013740093
Energy: 1.57367486241763
Energy: 1.4315439173174471
Energy: 1.1661429648496386
Energy: 1.5730370081894491
Energy: 1.4324031172692935
Energy: 1.160728222431118
Energy: 1.5753051620248788
Energy: 1.4192117612476443
Energy: 1.16874120120393
Energy: 1.4197507283816126
Energy: 1.5744183864672294
Energy: 1.1678415482407565
Energy: 1.5734308080401573
Energy: 1.4264544983863139
Energy: 1.1618410923738811
Energy: 1.5740859888649454
Energy: 1.60830290091582
Energy: 1.1674502386347134
Energy: 1.4158701650962098
Energy: 1.3588602570095865
Energy: 1.164730566844158
Energy: 1.3568380220791603
Energy: 1.6080294994201256
Energy: 1.162127478132606
Energy: 1.1849141856786316
Energy: 1.1830329220782618
Energy: 1.168034098218948
Energy: 1.1815626823867706
Energy: 1.4271239407411567
Energy: 1.1620702081966554
Energy: 1.3559695824091809
Energy: 1.3577174447824176
Energy: 1.1847528234374136
Energy: 1.3574577654474311
Energy: 1.5762932434349246
Energy: 1.1664253737291561
Energy: 1.5754111302861753
Energy: 1.1823166521300177
Energy: 1.178331569001725
Energy: 1.181642113693739
Energy: 1.609138552214429
Energy: 1.156976039999428
Energy: 1.3571321377044747
Energy: 1.1834689785711063
Energy: 1.184724531050839
Energy: 1.3575117635003024
Energy: 1.527368545968203

minimum gb energy = 1.1551205358347711 eV
minimum distance =  2.19305812021001 Angstroms
sigma value = 41


========================================
theta = 58.99241699313286
========================================

Energy: 2.031291359182358
Energy: 1.0625524646962854
Energy: 1.0774869020834983
Energy: 1.0758312243131092
Energy: 1.0781792858522905
Energy: 1.0770199239843314
Energy: 1.414724476056658
Energy: 1.2274650622232133
Energy: 1.073684975024044
Energy: 1.247276574310259
Energy: 1.2269326276480526
Energy: 1.3005082978550044
Energy: 1.4238618091204265
Energy: 1.22699709352272
Energy: 1.300955352535579
Energy: 1.0779161762614722
Energy: 1.2268999344213127
Energy: 1.4754380687478543
Energy: 1.0573954631275602
Energy: 1.2271999154067406
Energy: 1.076696816558348
Energy: 1.0774002104096154
Energy: 1.226759151347031
Energy: 1.4665995431679169
Energy: 1.0538881102654996
Energy: 1.424530015005187
Energy: 1.227572814074922
Energy: 1.2270792497334386
Energy: 1.2268299624456107
Energy: 1.4669881209681674
Energy: 1.2417801590143476
Energy: 1.47261825042006
Energy: 1.2997119888725417
Energy: 1.0784706980000327
Energy: 1.3290245968249172
Energy: 1.4717523259750553
Energy: 1.0610600567043573
Energy: 1.3289842882295047
Energy: 1.4723311255879241
Energy: 1.4725027416340717
Energy: 1.4729818299592703
Energy: 1.323742343104999
Energy: 1.4180312691755628
Energy: 1.4724322978780515
Energy: 1.323822568659388
Energy: 1.4665093640162155
Energy: 1.4755460590766805
Energy: 1.4680123240000091
Energy: 1.4269664706504062
Energy: 1.227563605578504
Energy: 1.4740528752741888
Energy: 1.4675979605717437
Energy: 1.475345303791217
Energy: 1.227291394730938
Energy: 1.2419689854584748
Energy: 1.3018722671688996
Energy: 1.2265780848845766
Energy: 1.4745309323591125
Energy: 1.2272176145414055
Energy: 1.2929784298409432
Energy: 1.242554588193738
Energy: 1.2275805996617541
Energy: 1.425969698738059
Energy: 1.4701878882390087
Energy: 1.4248274735243232
Energy: 1.225539007119842
Energy: 1.2427375336307207
Energy: 1.3010554697851333
Energy: 1.470261054677267
Energy: 1.4672292079125917
Energy: 1.226645828753291
Energy: 1.0769294399819094
Energy: 1.2391520563943315
Energy: 1.2258814078974816
Energy: 1.225106162952899
Energy: 1.4687553099449553
Energy: 1.226195190113797
Energy: 1.075564615599447
Energy: 1.0745020955973963
Energy: 1.0753765673398885
Energy: 1.0826908426715052
Energy: 1.0670575752470581
Energy: 1.0775779393169378
Energy: 1.0760968748266089
Energy: 1.077534332109959
Energy: 1.0764311690558637
Energy: 1.4709754910169857
Energy: 1.4739233412953072
Energy: 1.0748207409597148
Energy: 1.0787036198427011
Energy: 1.0763432033458322
Energy: 1.0781237435390048
Energy: 1.2266178763929352
Energy: 1.4667849687217702
Energy: 1.0759914710852778
Energy: 1.0762625494902107
Energy: 1.0746606435283088
Energy: 1.0762832285122002
Energy: 1.0531996657785692
Energy: 1.4948691390535982
Energy: 1.0764601738960884
Energy: 1.076342857702646
Energy: 1.244232135911329
Energy: 1.0759605119889828
Energy: 1.4260579252111634
Energy: 1.4738167027470235
Energy: 1.2266401436236274
Energy: 1.2615399213559297
Energy: 1.241831672317715
Energy: 1.0760721514297809
Energy: 1.4699204217752397
Energy: 1.467193943454847
Energy: 1.2276788798033238
Energy: 1.077391131454106
Energy: 1.2428548516373392
Energy: 1.2273848119440385
Energy: 1.4260669178711871
Energy: 1.4680130423923323
Energy: 1.4252336526233564
Energy: 1.2979588056126496
Energy: 1.2407139836945205
Energy: 1.3012192066436739
Energy: 1.4660291767611584
Energy: 1.4673038436061434
Energy: 1.2264387411539914
Energy: 1.0604906304553061
Energy: 1.0615696464204194
Energy: 1.227231558230092
Energy: 1.474531707226287
Energy: 1.4670216453924239
Energy: 1.4755498012375676
Energy: 1.226774765843185
Energy: 1.060843225352982
Energy: 1.472007731130291
Energy: 1.3238234800417834
Energy: 1.4643566207143734
Energy: 1.4742964969511574
Energy: 1.4713514015492906
Energy: 1.2419294345341625
Energy: 1.4731871261534701
Energy: 1.4716335026572558
Energy: 1.052059652052397
Energy: 1.4724866547108506
Energy: 1.3290279812612946
Energy: 1.423742021072535
Energy: 1.4723327721666866
Energy: 1.3327911922402462
Energy: 1.473295206154458
Energy: 1.3241312141894361
Energy: 1.4715111488281667
Energy: 1.4178125972340123
Energy: 1.4252459243939652
Energy: 1.2277744760429652
Energy: 1.2283699000364925
Energy: 1.227710794113326
Energy: 1.427371349667983
Energy: 1.4182077368513752
Energy: 1.227869802686237
Energy: 1.3013963733281608
Energy: 1.0774981667927248
Energy: 1.2270453959998664
Energy: 1.2269632743088277
Energy: 1.4241353190403878
Energy: 1.226538459499006
Energy: 1.2277843353610338
Energy: 1.077008185400253
Energy: 1.226212882074324
Energy: 1.4754100919996564
Energy: 1.242528462322802
Energy: 1.0787671869267366
Energy: 1.226257357644239
Energy: 1.2421594249376395
Energy: 1.225912822464515
Energy: 1.471489309665044
Energy: 1.235893839533969
Energy: 1.0767379052903177
Energy: 1.0593967916151754
Energy: 1.060212994965219
Energy: 1.0754939675753763
Energy: 1.067006894245388
Energy: 1.24511942551199
Energy: 1.2271336231332313
Energy: 1.2265497595634398
Energy: 1.0911323345938893
Energy: 1.2263486757393236
Energy: 1.0764954069797454
Energy: 1.241894073973335
Energy: 1.226021106372935
Energy: 1.0763200811050073
Energy: 1.0763132230409274
Energy: 1.0767510955201065
Energy: 1.4704099361608105
Energy: 1.4126119163498443
Energy: 1.0754459138680157
Energy: 1.0770388531551498
Energy: 1.0769047399587812
Energy: 1.076709167149738
Energy: 1.0519510638424987

minimum gb energy = 1.0519510638424987 eV
minimum distance =  2.28319143129728 Angstroms
sigma value = 33


========================================
theta = 62.439396894736774
========================================

Energy: 1.8938817076874555
Energy: 0.9221501369724151
Energy: 0.9331672844668851
Energy: 1.0276094739259098
Energy: 0.9332067891708317
Energy: 0.9375935038310973
Energy: 1.7812323722207781
Energy: 0.9388064003749634
Energy: 0.9378247375140267
Energy: 1.0545826008410235
Energy: 0.9438278965830419
Energy: 0.9367771296671247
Energy: 1.7967551275883735
Energy: 1.1201340896089835
Energy: 0.9332488476845487
Energy: 1.0559586305417856
Energy: 0.9348490134526044
Energy: 1.1193064369304118
Energy: 1.773436848644329
Energy: 0.9332704679397767
Energy: 0.9323000422148888
Energy: 1.0554038573602356
Energy: 0.9329049553911599
Energy: 1.2488927030378651
Energy: 1.7736043090997935
Energy: 0.9353669620280988
Energy: 0.9328429021234097
Energy: 1.0583545473787201
Energy: 0.9332547418830922
Energy: 1.2519962429676639
Energy: 1.7959509301538588
Energy: 1.1192495370150763
Energy: 1.1194908899857208
Energy: 1.225514783979341
Energy: 1.119377391409983
Energy: 1.2727823062181531
Energy: 1.7868271428043991
Energy: 1.273057027655965
Energy: 1.2634317505561083
Energy: 1.1177181862871666
Energy: 1.2673965805534555
Energy: 1.2745405480529572
Energy: 1.4663707861071504
Energy: 1.121075858624691
Energy: 0.9287964145074228
Energy: 1.2253172788015487
Energy: 0.9269493826472541
Energy: 1.2714802715270943
Energy: 1.6294949242283345
Energy: 1.2752181319378277
Energy: 1.2659416551293305
Energy: 1.2638198580388167
Energy: 1.2744809005009858
Energy: 1.2759123471641
Energy: 1.6446527126434844
Energy: 1.2762961316849488
Energy: 1.2752722879325717
Energy: 1.275820811232093
Energy: 1.2757621961624241
Energy: 1.275121300057647
Energy: 1.4722234674076906
Energy: 1.2749499094191954
Energy: 1.2768861692425477
Energy: 1.2747927662385516
Energy: 1.2768667015696813
Energy: 1.2751608141166773
Energy: 1.4721534616370346
Energy: 1.276370243418855
Energy: 1.2747906499904842
Energy: 1.2754171981447047
Energy: 1.2761559020632012
Energy: 1.2764436170583693
Energy: 1.6429670027914474
Energy: 1.2642935402312756
Energy: 1.2727588287534757
Energy: 1.2752450164359572
Energy: 1.267679459880137
Energy: 1.2618331798844145
Energy: 1.3280413223759246
Energy: 1.1194191614594153
Energy: 1.259785777479649
Energy: 1.2764610805351246
Energy: 1.1204527785321474
Energy: 1.1202668963089404
Energy: 1.1842054992966997
Energy: 1.2656180188564365
Energy: 1.2743557352886241
Energy: 1.2764675809978332
Energy: 1.274329768103092
Energy: 1.117491831427033
Energy: 1.3279723497523797
Energy: 1.1182952182790342
Energy: 1.1182765265973482
Energy: 1.2739653954691144
Energy: 1.1196621328925185
Energy: 1.1193618754836963
Energy: 1.1871299413626444
Energy: 0.9325329761359422
Energy: 1.2560608436741514
Energy: 1.2644002481826615
Energy: 0.9318927074043524
Energy: 1.0581988795811903
Energy: 1.0554123282813188
Energy: 0.9355414559658691
Energy: 1.1203006150985473
Energy: 1.275630176257651
Energy: 0.9353395887460219
Energy: 0.9356688476846118
Energy: 1.0547210789889485
Energy: 0.9325323349389627
Energy: 1.1198938933532256
Energy: 1.273182116809669
Energy: 0.9314802704559194
Energy: 0.9330148274473701
Energy: 1.053093752031436
Energy: 0.932555182624466
Energy: 0.942924203219822
Energy: 1.1188355080426975
Energy: 0.9351149691346325
Energy: 0.9325957007066547
Energy: 0.929952284031141
Energy: 0.9311508255210921
Energy: 0.9281937572180824
Energy: 1.2707070216931515
Energy: 0.9309763754085449
Energy: 0.930855849192809
Energy: 0.9322225455719203
Energy: 0.932845615416503
Energy: 0.9322605528134799
Energy: 1.2744272482777754
Energy: 0.9344559212277651
Energy: 0.9332212747161168
Energy: 0.9401373302508994
Energy: 0.9343754972944582
Energy: 0.9341772920617071
Energy: 1.2713162115253467
Energy: 0.9316699124149609
Energy: 0.9358700241909677
Energy: 0.9309682849021598
Energy: 0.9309322060904204
Energy: 0.9221209327459592
Energy: 1.2333683860776323
Energy: 0.931462599674203
Energy: 0.9311337147353732
Energy: 1.0523363733122248
Energy: 0.9344798064333976
Energy: 0.9360089217982329
Energy: 1.2675058768420255
Energy: 0.9398264315605152
Energy: 1.0557029138517513
Energy: 1.05649807618744
Energy: 0.9321131384964431
Energy: 1.119030747311289
Energy: 1.2731720014520183
Energy: 0.9330061607893939
Energy: 0.9325945037174675
Energy: 1.054514731563109
Energy: 0.9339597758293208
Energy: 0.9362056354595876
Energy: 1.27795303671085
Energy: 0.9341098841565451
Energy: 0.9330360306974408
Energy: 1.326224097744687
Energy: 0.9322617123686617
Energy: 1.2456198226813489
Energy: 1.2791958954828084
Energy: 0.9324063148983343
Energy: 0.9330035883027393
Energy: 1.3287168652170869
Energy: 1.1201075292756388
Energy: 1.1190730564840325
Energy: 1.2736650798029312
Energy: 1.1193094457580266
Energy: 1.1209014254721639
Energy: 1.3313088842755485
Energy: 1.2721153311670113
Energy: 1.2738505110926734
Energy: 1.2767675635065399
Energy: 1.2760838702156203
Energy: 1.2633902791619724
Energy: 1.3277355045325974
Energy: 1.1199511678915255
Energy: 1.2722995790991134
Energy: 1.2721952667157743
Energy: 1.1181220078937215
Energy: 1.1208054645901615
Energy: 1.630057042569932
Energy: 1.2680401370591172
Energy: 1.2749703459043036
Energy: 1.2762996192285305
Energy: 1.2752638632837083
Energy: 1.2646147047704817
Energy: 1.6298351231145352
Energy: 1.2755859742920994
Energy: 1.2753862260810258
Energy: 1.2758158910048116
Energy: 1.275859491368719
Energy: 1.2759293477627196
Energy: 1.629847539892396
Energy: 1.2758758189706383
Energy: 1.2755705782751423
Energy: 1.2671145600986802
Energy: 1.276529308952999
Energy: 1.2756406041978614
Energy: 1.6285074570215867
Energy: 1.2756245088637508
Energy: 1.2754512627523813
Energy: 1.267382147157981
Energy: 1.2770193279409061
Energy: 1.2753356320534621
Energy: 1.6278894776791846
Energy: 1.2753918242335278
Energy: 1.2651914025230462
Energy: 1.262176808637193
Energy: 1.2693940431014
Energy: 1.2748851493012783
Energy: 1.6229725345082218
Energy: 1.1191446430086593
Energy: 1.1205991403585975
Energy: 1.226212445916421
Energy: 1.1198580157313873
Energy: 1.2747365857096558
Energy: 1.6290771240775146
Energy: 1.2738515521678855
Energy: 1.1206903843634148
Energy: 1.1914774068662022
Energy: 1.2697867222545505
Energy: 1.2743548223728731
Energy: 1.799332686810092
Energy: 1.1179256520361718
Energy: 1.1211496453508067
Energy: 1.2252367406134588
Energy: 1.120610529214989
Energy: 1.1192229480615725
Energy: 1.622701310086109
Energy: 0.9326864263140426
Energy: 0.9329947418532254
Energy: 1.059335161464466
Energy: 0.9330781753650825
Energy: 1.2638180564614259
Energy: 1.7788519806786143
Energy: 0.9342800890494704
Energy: 0.9337657470190975
Energy: 0.9326550052809052
Energy: 0.9334355627381752
Energy: 1.1205404820649725
Energy: 1.798360040861275
Energy: 0.9315569949460799
Energy: 0.9327216285211993
Energy: 1.059868538593309
Energy: 0.9325069893116504
Energy: 1.1196724424887035
Energy: 1.7778976236471367
Energy: 0.935364852629926
Energy: 0.9335946945100841
Energy: 1.0536236509836678
Energy: 0.9340068533901327
Energy: 0.9363592545942082
Energy: 1.618810306601378
Energy: 0.9314593701260452
Energy: 0.9310277345887054
Energy: 0.9310268701130423
Energy: 0.9310587515886111
Energy: 1.2576483873763413
Energy: 1.630903705910397
Energy: 0.9328749173303716
Energy: 0.9340364131407878
Energy: 0.9371044529227595
Energy: 0.9382323023110912
Energy: 0.9352490022275065
Energy: 1.8011140271503332
Energy: 0.9325763569793555
Energy: 0.9324929178848679
Energy: 0.9332122728005522
Energy: 0.9327621212519429
Energy: 0.9326232073078075
Energy: 1.7834964213568139
Energy: 0.9321669036056465
Energy: 0.9307046731063388
Energy: 0.9301819321998345
Energy: 0.9307654560050378
Energy: 0.9236045528574792

minimum gb energy = 0.9221209327459592 eV
minimum distance =  2.2670455316807 Angstroms
sigma value = 67


========================================
theta = 70.52877936550931
========================================

Energy: 0.28490874759268675
Energy: 0.2854135696312415
Energy: 0.4379129532420689
Energy: 0.43660886097598556
Energy: 0.4397931299285476
Energy: 0.2850528123541734
Energy: 0.28434521645531585
Energy: 0.4341939867054814
Energy: 0.43180568968124244
Energy: 0.430884154806107
Energy: 0.43538897050295333
Energy: 0.43296980605634594
Energy: 1.7077324450858045
Energy: 0.4304441434298333
Energy: 0.4303761958036184
Energy: 0.4307890830812609
Energy: 0.4298699702664134
Energy: 0.43028803532855603
Energy: 0.2806478247414494
Energy: 0.4298313357285659
Energy: 0.42965098877637736
Energy: 0.43194444092973205
Energy: 0.42905408200831896
Energy: 0.2803792347836529
Energy: 0.28027713602772675
Energy: 0.4294786888311567
Energy: 0.4292713895023212
Energy: 0.43024306972655596
Energy: 0.4283035535176695
Energy: 0.28017756068980026
Energy: 1.707682556877816
Energy: 0.42985878748063644
Energy: 0.4302644820887798
Energy: 0.43187301122632893
Energy: 0.4288364948585888
Energy: 0.43021208972311176
Energy: 0.2833119282452507
Energy: 0.4319704196463679
Energy: 0.4308843595231296
Energy: 0.43075178464134795
Energy: 0.43148086920293355
Energy: 0.4312784469967989

minimum gb energy = 0.28017756068980026 eV
minimum distance =  2.44709347234446 Angstroms
sigma value = 3


========================================
theta = 77.88488253796277
========================================

Energy: 2.080455052262027
Energy: 0.9177881695295422
Energy: 0.911017904398814
Energy: 1.07929044865685
Energy: 0.9103532044993857
Energy: 1.1908593397041907
Energy: 1.718703462309032
Energy: 0.9105057694863974
Energy: 0.9116200352739299
Energy: 0.911599060793524
Energy: 0.9118986452473008
Energy: 1.057534601297669
Energy: 1.77124872672154
Energy: 0.9059577069739035
Energy: 0.9146962660000248
Energy: 0.9185280812336373
Energy: 0.9146540973454755
Energy: 0.9070397723040493
Energy: 1.8791844985909687
Energy: 0.9096752693813819
Energy: 0.9089493198271714
Energy: 0.9103789640313309
Energy: 0.9090362534684495
Energy: 1.052232317729585
Energy: 1.878493806955459
Energy: 0.9094241817104165
Energy: 0.9121606824601111
Energy: 1.0359813720253748
Energy: 0.9097006842501019
Energy: 1.0524815471638573
Energy: 1.7481089346158498
Energy: 0.9056719739661951
Energy: 0.9107767734903611
Energy: 1.0517138019933956
Energy: 0.9104566138535815
Energy: 1.0532869783428658
Energy: 1.726546727763958
Energy: 1.052789498661511
Energy: 0.910277643350604
Energy: 1.03076685723531
Energy: 1.05175620141431
Energy: 1.0532821017975649
Energy: 1.8580761489335842
Energy: 1.0553661848508504
Energy: 1.162983919111119
Energy: 1.0457279731090259
Energy: 1.0531808875378577
Energy: 1.2071910985676655
Energy: 1.729831834016665
Energy: 1.0536814764742972
Energy: 1.0546137586539464
Energy: 0.912077360197617
Energy: 1.0538010486999183
Energy: 1.0546793879194865
Energy: 1.747603247683232
Energy: 1.1969411160302348
Energy: 1.0545277353403057
Energy: 1.1783723105701083
Energy: 1.0525899338728
Energy: 1.1968985298562103
Energy: 1.7487447764269117
Energy: 1.1956133811069534
Energy: 1.197539712548068
Energy: 1.1804522435060494
Energy: 1.1975530415379003
Energy: 1.195730852471319
Energy: 1.7467285693085999
Energy: 1.1949571921214535
Energy: 1.1962567571442684
Energy: 1.1944628969828877
Energy: 1.1962303515985722
Energy: 1.195096185824102
Energy: 1.7352071010544903
Energy: 1.1953912174894452
Energy: 1.1963116775847698
Energy: 0.9069610739737686
Energy: 1.1966300915016856
Energy: 1.2116482267234054
Energy: 1.726564623323461
Energy: 1.206374560231937
Energy: 1.195168093572387
Energy: 1.1971462343288033
Energy: 1.2097335049838496
Energy: 1.2064632611553225
Energy: 1.5752809548467002
Energy: 1.207135065111127
Energy: 1.2072617889963362
Energy: 1.1941470627678579
Energy: 1.2069456175393258
Energy: 1.2078134539765792
Energy: 1.5808138042385669
Energy: 1.2177488502868385
Energy: 1.2077972508312926
Energy: 1.2078353447153183
Energy: 1.2067127368974824
Energy: 1.2072587821169236
Energy: 1.5780748850562414
Energy: 1.194386649663204
Energy: 1.2068557753474372
Energy: 1.2057919784254079
Energy: 1.208647144952533
Energy: 1.1955477922136055
Energy: 1.5800955576523148
Energy: 1.1972374004159239
Energy: 1.19461760340974
Energy: 1.236298702373968
Energy: 1.1954440590220492
Energy: 1.199244540976509
Energy: 1.5796525717980263
Energy: 1.1951165970957762
Energy: 1.1951695306992554
Energy: 1.2036802442037304
Energy: 1.194997568320711
Energy: 1.1958741822560994
Energy: 1.302269305600269
Energy: 1.195393947212821
Energy: 1.195143324416478
Energy: 1.2039962286753898
Energy: 1.1952007795275534
Energy: 1.0547260723002763
Energy: 1.302496520092278
Energy: 1.0537495240535957
Energy: 1.1976101229640297
Energy: 1.213677401899022
Energy: 1.05540245961821
Energy: 1.053751249770561
Energy: 1.2957293044313363
Energy: 1.053963377132109
Energy: 1.0539697570974353
Energy: 1.210229895461142
Energy: 1.0521422215833502
Energy: 0.9115170516357046
Energy: 1.0448160207596975
Energy: 1.053326371261526
Energy: 1.1844302819525088
Energy: 1.2191603770015405
Energy: 1.1600649142068316
Energy: 1.0622317031313366
Energy: 1.029329387591155
Energy: 0.9100970612133239
Energy: 1.0533061020850238
Energy: 1.239794607621394
Energy: 1.0544939446238786
Energy: 0.9108338107724706
Energy: 1.0410876188310803
Energy: 0.9109123892762273
Energy: 0.9068205708566632
Energy: 1.2060910852461972
Energy: 0.9062952561724952
Energy: 0.9114945820453341
Energy: 1.0345170124653855
Energy: 0.9091672555563822
Energy: 0.9077804533060387
Energy: 1.1804095880528565
Energy: 0.9088432024220189
Energy: 0.9118971990907494
Energy: 0.9091475384484642
Energy: 0.9094815581855077
Energy: 0.909039742878451
Energy: 0.9120164073361594
Energy: 0.9088133920443529
Energy: 0.9091319800861398
Energy: 0.9136946201409065
Energy: 0.9154270946633274
Energy: 0.906378618643345
Energy: 1.2064094829796606
Energy: 0.9100308755469664
Energy: 0.9155728629133673
Energy: 0.91305419740885
Energy: 0.910840324671462
Energy: 1.0540886546203192
Energy: 1.205222128706018
Energy: 0.9125543982898232
Energy: 0.9109630875276232
Energy: 0.9128093286527805
Energy: 0.9095860198987276
Energy: 1.054728549046674
Energy: 1.2061348904714222
Energy: 0.9091659226503865
Energy: 1.0246836191018533
Energy: 1.0409026741844511
Energy: 0.910397769346272
Energy: 1.0590981886083117
Energy: 1.2061043657278836
Energy: 0.9088879201465262
Energy: 0.9114797371883226
Energy: 1.0332633441012766
Energy: 0.9094227614931594
Energy: 1.059451874949752
Energy: 1.2379712210025133
Energy: 1.0565660669076196
Energy: 0.9108819868473758
Energy: 1.0349899746623752
Energy: 1.0530133592297977
Energy: 1.0537929211117876
Energy: 1.213296488747096
Energy: 1.0531754691817907
Energy: 0.9111417972153172
Energy: 1.2956211175181498
Energy: 1.0557221125094194
Energy: 1.0523461971837036
Energy: 1.0763810761810937
Energy: 1.0526340787925903
Energy: 1.0545092025902925
Energy: 1.2958625002349062
Energy: 1.0529768311428973
Energy: 1.0527804635948472
Energy: 1.211030480654835
Energy: 1.0531479527574017
Energy: 1.0554534050982014
Energy: 1.293507998698035
Energy: 1.0557921271265323
Energy: 1.1953127666852603
Energy: 1.2066511920116703
Energy: 1.1954605418951736
Energy: 1.0567850739079176
Energy: 1.2948009353188423
Energy: 1.199432011648215
Energy: 1.1965652391492936
Energy: 1.2126774284447357
Energy: 1.1961968139548005
Energy: 1.1959974178948216
Energy: 1.433728781399076
Energy: 1.2035374770801508
Energy: 1.1962561448362725
Energy: 1.2374583542249689
Energy: 1.1966203410931577
Energy: 1.1805609628815403
Energy: 1.5801231253636332
Energy: 1.1958161289964067
Energy: 1.2069502828743193
Energy: 1.2166393510159403
Energy: 1.2149434683410882
Energy: 1.1957863705573795
Energy: 1.597063749830408
Energy: 1.2070010732468122
Energy: 1.2069557996931464
Energy: 1.0560547952588542
Energy: 1.2094253110096953
Energy: 1.2072484761277928
Energy: 1.7205627334983649
Energy: 1.2065898541470808
Energy: 1.2061589007202314
Energy: 1.205692274570302
Energy: 1.2068954797313916
Energy: 1.2063414410714945
Energy: 1.7212857350823731
Energy: 1.2069918034154643
Energy: 1.2067012057001114
Energy: 1.199002232999501
Energy: 1.2080806654776184
Energy: 1.2067344100981086
Energy: 1.7245629778919376
Energy: 1.2162385400514244
Energy: 1.196451244259116
Energy: 1.195135135517462
Energy: 1.1965805985804507
Energy: 1.2080175677408143
Energy: 1.7274187553287967
Energy: 1.1949530742288492
Energy: 1.1985648481598519
Energy: 1.1846655376396875
Energy: 1.1988232868791742
Energy: 1.2060613470099741
Energy: 1.778562862661854
Energy: 1.196737300348837
Energy: 1.1956894072719333
Energy: 1.1830355912888408
Energy: 1.1951909878013578
Energy: 1.2066301394747034
Energy: 1.727049162183001
Energy: 1.1955753063054122
Energy: 1.1656812583390974
Energy: 1.180816286689732
Energy: 1.0596254439592456
Energy: 1.1946075796122853
Energy: 1.7265856547749507
Energy: 1.0548966868099396
Energy: 1.0541372826288244
Energy: 0.9107597040897107
Energy: 1.0537569352711418
Energy: 1.1824309738871113
Energy: 1.7511478993893423
Energy: 1.0535953910025295
Energy: 1.0536072736521207
Energy: 1.1791881002668259
Energy: 1.0540428544321927
Energy: 1.1811046615441365
Energy: 1.7509884878259308
Energy: 1.0531622965486243
Energy: 0.9115530846461865
Energy: 1.034498223696411
Energy: 1.0518188022468422
Energy: 1.1809023543475936
Energy: 1.747214504921833
Energy: 0.9063805420682073
Energy: 0.9114315756234669
Energy: 1.0367277554627656
Energy: 0.9116343873762447
Energy: 0.9088322548960909
Energy: 1.7188204513245813
Energy: 0.913050177717526
Energy: 0.9105379960728123
Energy: 1.0508633951269444
Energy: 0.9102442846388363
Energy: 1.057491531026387

minimum gb energy = 0.9056719739661951 eV
minimum distance =  2.2681411668058 Angstroms
sigma value = 81


========================================
theta = 80.63108442154517
========================================

Energy: 2.3590612401479163
Energy: 1.0243530840335875
Energy: 1.0310044795022808
Energy: 1.209979873423202
Energy: 1.1045297032115708
Energy: 1.385832163088358
Energy: 1.7051685211281877
Energy: 1.0285695745243981
Energy: 1.0274056606947604
Energy: 1.0285458873969018
Energy: 1.027671808066414
Energy: 1.2244348771179796
Energy: 1.5737045696587943
Energy: 1.0225643712593981
Energy: 1.0322820151842695
Energy: 1.0331549012024754
Energy: 1.0323885961918202
Energy: 1.0240614877922898
Energy: 1.694638938466598
Energy: 1.0274012844542475
Energy: 1.0257554805172102
Energy: 1.0277648553043333
Energy: 1.0264031227781438
Energy: 1.0189689238763195
Energy: 1.6949763287174158
Energy: 1.0274698212959936
Energy: 1.0262218474518878
Energy: 1.2072225149395743
Energy: 1.027029076642968
Energy: 1.0188616376694672
Energy: 1.5799514712732954
Energy: 1.0229205645605708
Energy: 1.0278465905746736
Energy: 1.0267191844212906
Energy: 1.0270223849353646
Energy: 1.0236693651986828
Energy: 1.6063519041584455
Energy: 1.2252912024695062
Energy: 1.0279511077179062
Energy: 1.199806210895572
Energy: 1.0285137380003369
Energy: 1.22547149265606
Energy: 1.4723706145985922
Energy: 1.3650450515220545
Energy: 1.3901532413223356
Energy: 1.2162997467916743
Energy: 1.388227875815098
Energy: 1.3984808253613947
Energy: 1.6063448134732894
Energy: 1.0303731335020268
Energy: 1.2207001077160997
Energy: 1.0188304383225961
Energy: 1.2249992389181732
Energy: 1.2259848386271548
Energy: 1.5796426701664232
Energy: 1.3895335982537689
Energy: 1.3625869341940138
Energy: 1.4029097003681053
Energy: 1.2253064682099999
Energy: 1.3897952517515701
Energy: 1.6595787284237764
Energy: 1.3383195633579863
Energy: 1.3869730881479874
Energy: 1.382675322078927
Energy: 1.3881564627110323
Energy: 1.3402954402941467
Energy: 1.4106673879853846
Energy: 1.3875695073342484
Energy: 1.3874278841322496
Energy: 1.3857391235784875
Energy: 1.3890780379825218
Energy: 1.3380141908791467
Energy: 1.392547194017955
Energy: 1.3387748549940592
Energy: 1.387866469816597
Energy: 1.0198592548252958
Energy: 1.3876297445010015
Energy: 1.3115238971808554
Energy: 1.5808019126803607
Energy: 1.3115722199300104
Energy: 1.3894678857605418
Energy: 1.3799145985689136
Energy: 1.31249875728157
Energy: 1.3120384871276933
Energy: 1.5820879426280698
Energy: 1.2263135415885218
Energy: 1.2219928545314436
Energy: 1.2638018703111975
Energy: 1.3075557083983058
Energy: 1.017214958341916
Energy: 1.3767505539330058
Energy: 1.3112380559937775
Energy: 1.374160205385405
Energy: 1.0189113102496514
Energy: 1.3128452458336717
Energy: 1.3239350731819426
Energy: 1.2830322942458101
Energy: 1.0170816203543098
Energy: 1.3111718531724887
Energy: 1.382462307254918
Energy: 1.3104910193527881
Energy: 1.0173233244813673
Energy: 1.2810310643268699
Energy: 1.013640603422126
Energy: 1.0147146065612054
Energy: 1.3791552607842614
Energy: 1.0139714252279572
Energy: 1.0133918711333063
Energy: 1.2859392631858928
Energy: 1.0147739902995776
Energy: 1.0152785238490807
Energy: 1.3778135811433019
Energy: 1.015545916774569
Energy: 1.0149108664802449
Energy: 1.1083794340858415
Energy: 1.0159200570829188
Energy: 1.0155663591274586
Energy: 1.3780871680570055
Energy: 1.0155541477800214
Energy: 1.0155847273208014
Energy: 1.116795647701283
Energy: 1.0149172957974595
Energy: 1.013876696465395
Energy: 1.3802220894160855
Energy: 1.0158227479489443
Energy: 1.01513206787862
Energy: 1.1135667845326198
Energy: 1.0258722442495745
Energy: 1.3604992329727812
Energy: 1.3935829408520082
Energy: 1.0269172108825448
Energy: 1.0261838671955177
Energy: 1.1173926674999413
Energy: 1.1321406583563043
Energy: 1.3563838717906131
Energy: 1.3757950106959305
Energy: 1.1324684164230452
Energy: 1.132231601289743
Energy: 1.2068442903682932
Energy: 1.0264112130807341
Energy: 1.3606519738297094
Energy: 1.2191157381921638
Energy: 1.0267635269975464
Energy: 1.0262858838821132
Energy: 1.212021545126307
Energy: 1.1295977734325526
Energy: 1.129536768496364
Energy: 1.3798040918213237
Energy: 1.130368846023838
Energy: 1.1298911417821116
Energy: 1.2123359647571919
Energy: 1.1575350082388394
Energy: 1.1579082557265472
Energy: 1.3935199987324967
Energy: 1.1576959384004322
Energy: 1.13476632078227
Energy: 1.5717201212474148
Energy: 1.3600411052861465
Energy: 1.156305563190282
Energy: 1.3861823742525112
Energy: 1.157577682835243
Energy: 1.1560961814966992
Energy: 1.4648834799045156
Energy: 1.1329264507858485
Energy: 1.2240076145403196
Energy: 1.4845236500417323
Energy: 1.223022554700128
Energy: 1.1321212113879309
Energy: 1.571078718213578
Energy: 1.1565411637007612
Energy: 1.3904195702345044
Energy: 1.3886673480746272
Energy: 1.390477773939144
Energy: 1.2221120904398761
Energy: 1.3925039865027913
Energy: 1.4069354413517399
Energy: 1.3966921557812049
Energy: 1.0197889592963836
Energy: 1.3907627792626915
Energy: 1.3923666273251942
Energy: 1.668579012684643
Energy: 1.3915720024375298
Energy: 1.3903983780923594
Energy: 1.4055356419891982
Energy: 1.3911897262095412
Energy: 1.3746535199968277
Energy: 1.585054062397338
Energy: 1.3902811952761753
Energy: 1.2285643156106096
Energy: 1.4063146032548401
Energy: 1.3922181312058302
Energy: 1.3903288563488927
Energy: 1.5748259053497855
Energy: 1.2279991903220884
Energy: 1.2272970413816724
Energy: 1.028593397697673
Energy: 1.2269947951238387
Energy: 1.3907290635527851
Energy: 1.4810017507635003
Energy: 1.2276241798094858
Energy: 1.2277511200775546
Energy: 1.3157555101176008
Energy: 1.2278241580346156
Energy: 1.3712579678401888
Energy: 1.665460473675119
Energy: 1.227966092262241
Energy: 1.0290115695959725
Energy: 1.2013191861788222
Energy: 1.2281343148936308
Energy: 1.3722391810007826
Energy: 1.5799035118661846
Energy: 1.228976783635897
Energy: 1.027268134568565
Energy: 1.2017536186407485
Energy: 1.0264476633133255
Energy: 1.2325698610876634
Energy: 1.6065931199418924
Energy: 1.0242462161680808
Energy: 1.02728484257964
Energy: 1.0263290876078475
Energy: 1.028888070687266
Energy: 1.026131700228798
Energy: 1.6938509031019768
Energy: 1.0280901252467924
Energy: 1.026598598090399
Energy: 1.0279721096431356
Energy: 1.02760846806416
Energy: 1.3739197771430967

minimum gb energy = 1.0133918711333063 eV
minimum distance =  2.28784710716522 Angstroms
sigma value = 43


========================================
theta = 82.945868617881
========================================

Energy: 2.1125128839542944
Energy: 1.0950960194576662
Energy: 1.093754469108339
Energy: 1.0957205482097823
Energy: 1.1007329286763532
Energy: 1.0927325333044704
Energy: 1.556280274336018
Energy: 1.09469670105252
Energy: 1.0951795699415585
Energy: 1.0955784258145904
Energy: 1.095038057099063
Energy: 1.5032754123002845
Energy: 1.5537677010324413
Energy: 1.09099816106057
Energy: 1.0987763098901338
Energy: 1.099306080283204
Energy: 1.0935552031632574
Energy: 1.5228553525564588
Energy: 1.5805842701364612
Energy: 1.0944587236386183
Energy: 1.0944409734111165
Energy: 1.0950718387290208
Energy: 1.094072794920314
Energy: 1.5004075363123508
Energy: 1.579821513996708
Energy: 1.0943259540200965
Energy: 1.0947564088491906
Energy: 1.0951993788674357
Energy: 1.0958053969328945
Energy: 1.4992825174669688
Energy: 1.5536961606306918
Energy: 1.0942436591468883
Energy: 1.0950631370196937
Energy: 1.0942430532313685
Energy: 1.0954033631130917
Energy: 1.5227494729974276
Energy: 1.5853578930763519
Energy: 1.5022688355328357
Energy: 1.0963357343575126
Energy: 1.3163279716338963
Energy: 1.0970576689714324
Energy: 1.5029946150567977
Energy: 1.547737733565853
Energy: 1.5038069756273595
Energy: 1.3624276338790806
Energy: 1.3346992401301219
Energy: 1.5019429082159812
Energy: 1.5099440745220192
Energy: 1.582962220551811
Energy: 1.524629745964882
Energy: 1.3424899923820257
Energy: 1.0941027742292282
Energy: 1.5032088656325657
Energy: 1.5028065105834896
Energy: 1.5549389459974514
Energy: 1.5027317895697276
Energy: 1.502727191753221
Energy: 1.5755177277103523
Energy: 1.5039542623331505
Energy: 1.5029560326617255
Energy: 1.5533843936681568
Energy: 1.3447581608384243
Energy: 1.502967374615074
Energy: 1.3171076090119977
Energy: 1.502402633994995
Energy: 1.3420702338851334
Energy: 1.5536155892708823
Energy: 1.5023988062433735
Energy: 1.502069263819909
Energy: 1.5155223609447437
Energy: 1.5020518052014136
Energy: 1.3438146886999407
Energy: 1.316455604574515
Energy: 1.3444258049764954
Energy: 1.5157006260120973
Energy: 1.0883289159979919
Energy: 1.5030466101400524
Energy: 1.0953465671189784
Energy: 1.3170947126689694
Energy: 1.0959229042601362
Energy: 1.5220433807711884
Energy: 1.093801856691462
Energy: 1.3442343231602765
Energy: 1.0941472155832865
Energy: 1.3177096597759486
Energy: 1.095762628859085
Energy: 1.091049199609218
Energy: 1.3437097041869268
Energy: 1.0953896550284252
Energy: 1.0955366798693502
Energy: 1.0955867495171694
Energy: 1.0954517000712498
Energy: 1.471742750855791
Energy: 1.0874294358253593
Energy: 1.0952435060492722
Energy: 1.0946949333911078
Energy: 1.0937206467753444
Energy: 1.0944665710577992
Energy: 1.0969477210159668
Energy: 1.0899151370018023
Energy: 1.095335783905366
Energy: 1.0946176962646141
Energy: 1.097405480037099
Energy: 1.0988093283734097
Energy: 1.090674577673042
Energy: 1.3529024971712906
Energy: 1.091736768890587
Energy: 1.0990844147624543
Energy: 1.0935952690490383
Energy: 1.0940878253240558
Energy: 1.0943953199249807
Energy: 1.5473926240415083
Energy: 1.0946213659397874
Energy: 1.0939827617750963
Energy: 1.0935707872849945
Energy: 1.0958458086647005
Energy: 1.0945190561916214
Energy: 1.5050153962134387
Energy: 1.0945507874241283
Energy: 1.0944628459168122
Energy: 1.3308399967244242
Energy: 1.0957374174508367
Energy: 1.090673929075116
Energy: 1.3442215095623213
Energy: 1.091053378636678
Energy: 1.0960769742427314
Energy: 1.314368165760142
Energy: 1.096732292031422
Energy: 1.503273632518596
Energy: 1.52114164516574
Energy: 1.3422901426305052
Energy: 1.0961099366471834
Energy: 1.3336016145862375
Energy: 1.344942799696447
Energy: 1.5020161259964566
Energy: 1.0910711358651455
Energy: 1.5201978933545284
Energy: 1.0930875493086312
Energy: 1.5374707497753588
Energy: 1.345494853327458
Energy: 1.5299440787359697
Energy: 1.3183291907928991
Energy: 1.5034596469061203
Energy: 1.0977830634984715
Energy: 1.555154454371358
Energy: 1.5024692278467198
Energy: 1.5028914435082108
Energy: 1.3170346274876739
Energy: 1.5031740089150043
Energy: 1.342870407479592
Energy: 1.552990710017692
Energy: 1.5027996721861065
Energy: 1.3434262606420144
Energy: 1.0947659210376843
Energy: 1.5021871215485212
Energy: 1.3425908483544833
Energy: 1.5368724835268266
Energy: 1.5020411309136326
Energy: 1.3431740773257237
Energy: 1.0951775809370528
Energy: 1.503040954112877
Energy: 1.502092060439894
Energy: 1.5364034642171023
Energy: 1.5035128789573284
Energy: 1.0965255344719367
Energy: 1.3171472563273596
Energy: 1.3459320563832964
Energy: 1.533850071373855
Energy: 1.582486852625632
Energy: 1.5051686882147484
Energy: 1.0961080006673036
Energy: 1.3171514932289938
Energy: 1.0948502627012189
Energy: 1.5222629948733837
Energy: 1.5569745684994616
Energy: 1.0908971779517938
Energy: 1.0960168627586473
Energy: 1.094487270130936
Energy: 1.0960821514469634
Energy: 1.522091095124514
Energy: 1.5345873114705417
Energy: 1.0948914032747323
Energy: 1.0957711546977715
Energy: 1.0932333996658206
Energy: 1.0957950157434209
Energy: 1.0883753988787703

minimum gb energy = 1.0874294358253593 eV
minimum distance =  2.27742986602 Angstroms
sigma value = 57


========================================
theta = 86.6277133165661
========================================

Energy: 1.939205524345825
Energy: 1.6971747275089748
Energy: 1.1935430858759877
Energy: 1.192956666143091
Energy: 1.209425423300911
Energy: 1.7007782975846606
Energy: 1.193708466166777
Energy: 1.1937779761687835
Energy: 1.1917766993051984
Energy: 1.1921747981114728
Energy: 1.1917434153430262
Energy: 1.6931747822222722
Energy: 1.194526140991523
Energy: 1.195126016575984
Energy: 1.1932102797374888
Energy: 1.1932671848929628
Energy: 1.1936573606992606
Energy: 1.6895665495344567
Energy: 1.4971037552610513
Energy: 1.4543052685466056
Energy: 1.1957855039447454
Energy: 1.1975550793063863
Energy: 1.195366962937541
Energy: 1.485578038277866
Energy: 1.4974850351559852
Energy: 1.4535243573263228
Energy: 1.1940691110050776
Energy: 1.1924164050507868
Energy: 1.454001332579577
Energy: 1.48621723299661
Energy: 1.1955487787451622
Energy: 1.454530257608907
Energy: 1.1966666279837703
Energy: 1.1924209931433978
Energy: 1.1932649679414253
Energy: 1.4930027221036466
Energy: 1.1921501352993278
Energy: 1.69365443700393
Energy: 1.1970040908515678
Energy: 1.1922300077021377
Energy: 1.1945166686258197
Energy: 1.4943258024968848
Energy: 1.4973724288891594
Energy: 1.6940024209834204
Energy: 1.4953984963712519
Energy: 1.1937671003545407
Energy: 1.4936411819255688
Energy: 1.6887439758079386
Energy: 1.1939046181452861
Energy: 1.494591530540448
Energy: 1.6784596405669008
Energy: 1.1898216882270047
Energy: 1.6937041618863387
Energy: 1.4956705263081995
Energy: 1.5040251491771515
Energy: 1.1946610017203574
Energy: 1.6922590086821272
Energy: 1.5077678595954807
Energy: 1.6959984151448555
Energy: 1.198708136130031
Energy: 1.5066878409585758
Energy: 1.1970708807329296
Energy: 1.7110458379742106
Energy: 1.193995836805845
Energy: 1.4531359437683906
Energy: 1.1921304278300835
Energy: 1.5051631613512686
Energy: 1.4528214318143593
Energy: 1.1944552854044297
Energy: 1.1947369969670958
Energy: 1.452578727549365
Energy: 1.1936721149921947
Energy: 1.198954361883098
Energy: 1.1970468156822558
Energy: 1.6782905194274553
Energy: 1.6815266332466612
Energy: 1.4543234816387058
Energy: 1.1975819527814764
Energy: 1.1914210653439103
Energy: 1.193053789546484
Energy: 1.691758808421342
Energy: 1.1937459088279192
Energy: 1.1935410803151492
Energy: 1.1931139615753386
Energy: 1.1907636053149033
Energy: 1.1915478651920781
Energy: 1.4645678043442225
Energy: 1.1984595424816071
Energy: 1.1931894601999944
Energy: 1.1917449757149698
Energy: 1.1937386971189696
Energy: 1.1926235141663941
Energy: 1.6880178462758155
Energy: 1.4922772120482217
Energy: 1.1943951917010356
Energy: 1.1929280722024251
Energy: 1.5056463086135694
Energy: 1.1959159627701268
Energy: 1.1940477665367228
Energy: 1.1961730160101438
Energy: 1.4538576909455618
Energy: 1.192518906863834
Energy: 1.5057788348702275
Energy: 1.453299043089009
Energy: 1.5121854884643082
Energy: 1.2009420478744424
Energy: 1.453018887695406
Energy: 1.1932563323070988
Energy: 1.195847120801581
Energy: 1.1958983535936327
Energy: 1.6921319793299818
Energy: 1.4905559314141237
Energy: 1.696207588430684
Energy: 1.1925035612147803
Energy: 1.1917984795484378
Energy: 1.4915365494492159
Energy: 1.692224139446038
Energy: 1.4913896113705718
Energy: 1.6966445488987754
Energy: 1.4964661673298973
Energy: 1.8092574290839316
Energy: 1.695583695212339
Energy: 1.4937076138303196
Energy: 1.200941878029474
Energy: 1.4960124140117732
Energy: 1.186519085283032
Energy: 1.504109259804407
Energy: 1.6931704192875314
Energy: 1.4551200163665055
Energy: 1.5053505223447046
Energy: 1.4534760417871109
Energy: 1.4909949753180225
Energy: 1.195642686106357
Energy: 1.194329196817818
Energy: 1.1926505679147459
Energy: 1.192732921611523
Energy: 1.1930717205979968
Energy: 1.7283567939074422
Energy: 1.1899897815148315
Energy: 1.4542990658541746
Energy: 1.1962441546297151
Energy: 1.193654653844022
Energy: 1.4545351902081394
Energy: 1.6798715371522672

minimum gb energy = 1.186519085283032 eV
minimum distance =  2.27055940660346 Angstroms
sigma value = 17


========================================
theta = 93.3722866834339
========================================

Energy: 2.4739483257226778
Energy: 1.3099297240872667
Energy: 1.308015919394109
Energy: 1.5380728142707463
Energy: 1.3084491247303494
Energy: 1.3076959855642072
Energy: 1.3025433660338583
Energy: 1.6733397100194958
Energy: 1.3078642102958682
Energy: 1.3092067362886226
Energy: 1.3079765706893083
Energy: 1.3065706198973386
Energy: 1.3096549595989488
Energy: 1.4198117475727408
Energy: 1.3024322259512748
Energy: 1.3036830446122605
Energy: 1.3024837500023085
Energy: 1.3081867528537154
Energy: 1.2987550263112733
Energy: 1.319334652634737
Energy: 1.307419498743833
Energy: 1.3066109081659278
Energy: 1.3062866967699214
Energy: 1.3174063114748025
Energy: 1.3184547613080755
Energy: 1.4308753160791428
Energy: 1.3053317854644237
Energy: 1.3254913470342573
Energy: 1.3055149835420776
Energy: 1.4280036311843631
Energy: 1.3085998410544653
Energy: 1.4193424534424572
Energy: 1.6765587502999082
Energy: 1.2963711917635141
Energy: 1.6742131885155083
Energy: 1.3093694349910865
Energy: 1.3244000138970384
Energy: 1.305460475395975
Energy: 1.3076630463498675
Energy: 1.3235400997566877
Energy: 1.4292388457387335
Energy: 1.3142019383776242
Energy: 1.3092689846161332
Energy: 1.6754722809140001
Energy: 1.3097307507691887
Energy: 1.3241509863659915
Energy: 1.4180513062623603
Energy: 1.3062152418762545
Energy: 1.3252064105955004
Energy: 1.3062047345908834
Energy: 1.2960032671080655
Energy: 1.3031785547738688
Energy: 1.3212909152017978
Energy: 1.3232543490574666
Energy: 1.3146892819913063
Energy: 1.311945672102012
Energy: 1.4306669414730604
Energy: 1.306495419962616
Energy: 1.3114239785021626
Energy: 1.311872616733616
Energy: 1.3003595551795208
Energy: 1.302359828803428
Energy: 1.4192166794609504
Energy: 1.3090912304011837
Energy: 1.301971814268117
Energy: 1.3019886054361305
Energy: 1.3182007507254778
Energy: 1.31383538509822
Energy: 1.4307712175508756
Energy: 1.3188148291570603
Energy: 1.3050011842254274
Energy: 1.3137798454836964
Energy: 1.3241172405560417
Energy: 1.3069967306882049
Energy: 1.3189653306468663
Energy: 1.2971096500024837
Energy: 1.320150561582674
Energy: 1.3241578018015299
Energy: 1.2947622650922663
Energy: 1.6775812253098739
Energy: 1.4204151419135178
Energy: 1.3107377930140596
Energy: 1.6775292210465347
Energy: 1.2941533601632695
Energy: 1.3241385755479245
Energy: 1.305616976879777
Energy: 1.3066210234825226
Energy: 1.3236076698493617
Energy: 1.4291627850341782
Energy: 1.305424520855366
Energy: 1.3087939286488464
Energy: 1.4191777234837921
Energy: 1.6792315429204283
Energy: 1.3039066335846177
Energy: 1.6747220769167528
Energy: 1.3089226255857087
Energy: 1.2958540075814209
Energy: 1.4272370104295464
Energy: 1.3062547160294402
Energy: 1.3251367676567662
Energy: 1.305576909026598
Energy: 1.3039405154433787

minimum gb energy = 1.2941533601632695 eV
minimum distance =  2.28295582033142 Angstroms
sigma value = 17


========================================
theta = 97.054131382119
========================================

Energy: 2.7328998546670964
Energy: 1.333956546606989
Energy: 1.368354033868182
Energy: 1.3679161658701144
Energy: 1.384786325752197
Energy: 1.3416783281291602
Energy: 1.408095361278766
Energy: 1.362905969747896
Energy: 1.3631548453546187
Energy: 1.3680747665156199
Energy: 1.3638973812652193
Energy: 1.3615344029294674
Energy: 1.3627730376574976
Energy: 1.6053932154359922
Energy: 1.3637810274396593
Energy: 1.3662855647411527
Energy: 1.363051620794163
Energy: 1.3230703927485594
Energy: 2.006275058249904
Energy: 1.9239437357970541
Energy: 1.3684755442768257
Energy: 1.365402101416917
Energy: 1.3671191406975782
Energy: 1.606352235307931
Energy: 1.5731585834438826
Energy: 1.6069608827877877
Energy: 1.6003224192152965
Energy: 1.3643062589314283
Energy: 1.6010283254087547
Energy: 1.6092994591546192
Energy: 1.363788339363694
Energy: 1.37331862509632
Energy: 1.993622491048242
Energy: 1.3208699338401326
Energy: 1.6897557297351238
Energy: 1.3683235236132987
Energy: 1.3714918694595006
Energy: 1.3635064146559372
Energy: 1.6029113195908822
Energy: 1.3653365952903125
Energy: 1.3650891726541676
Energy: 1.3625089491557174
Energy: 1.364492398544569
Energy: 1.3614537241791764
Energy: 1.3612242194576698
Energy: 1.365524948490586
Energy: 1.3609559749238007
Energy: 1.362093681432503
Energy: 1.3653884210594394
Energy: 1.364595948418199
Energy: 1.61437310822941
Energy: 1.3600843597816905
Energy: 1.3650218698510297
Energy: 1.3651330092022316
Energy: 1.613076423514391
Energy: 1.362149400755248
Energy: 1.3603215879842827
Energy: 1.3763831592782396
Energy: 1.3603717747945299
Energy: 1.3616181231230833
Energy: 1.6073931899962954
Energy: 1.3605053398881821
Energy: 1.6168766707135103
Energy: 1.3625985536221714
Energy: 1.3610815769208968
Energy: 1.361259806935364
Energy: 1.6027059661789786
Energy: 1.3644485845308412
Energy: 1.3272864009685608
Energy: 1.3259177903964372
Energy: 1.6159848543432662
Energy: 1.3626435318495802
Energy: 1.4214260424538856
Energy: 1.614093924352315
Energy: 1.3227380319515327
Energy: 1.3259925655342497
Energy: 1.6822246407527757
Energy: 1.3659079856810803
Energy: 1.3196325934361512
Energy: 1.3270846967238055
Energy: 1.3624644797802572
Energy: 1.3267807846840685
Energy: 1.3255405489543226
Energy: 1.8418864636430086
Energy: 1.6684715058336674
Energy: 1.322177351523082
Energy: 1.324568003531919
Energy: 1.3333744832838907
Energy: 1.3250911119235649
Energy: 1.614766366175906
Energy: 1.446470356231824
Energy: 1.3236780052736987
Energy: 1.3223196565674928
Energy: 1.323200717028865
Energy: 1.3222855589985967
Energy: 1.3382407603859505
Energy: 2.0070785213150617
Energy: 1.323115619691421
Energy: 1.3250162383795892
Energy: 1.3299760015576456
Energy: 1.3261091849382816
Energy: 1.605015547025013
Energy: 2.006640477462262
Energy: 1.615294609422098
Energy: 1.3245506718547373
Energy: 1.5744329057767945
Energy: 1.3251560625128833
Energy: 1.6052651294502145
Energy: 1.6086775307187853
Energy: 1.6418783955764427
Energy: 1.6815465577629871
Energy: 1.3219080233057372
Energy: 1.6814336256275204
Energy: 1.3649771744252044
Energy: 1.6177331681229108
Energy: 1.3616897373243526
Energy: 1.3280641766549452
Energy: 1.5750465444193524
Energy: 1.6154331186704542
Energy: 1.3609652396356968
Energy: 1.6066723429536136
Energy: 1.3595104869289558
Energy: 1.6476145945450473
Energy: 1.3678600492082404
Energy: 1.364781441975528
Energy: 1.361256572713687
Energy: 1.3803699912582734
Energy: 1.3653923125268146
Energy: 1.3204642904639048
Energy: 1.398270131191764
Energy: 1.3621391725838528
Energy: 1.3645810614262772
Energy: 1.3684280824588746
Energy: 1.3630125640914805
Energy: 1.3603574804230127
Energy: 1.562940227376804
Energy: 1.362381519797383
Energy: 1.3629390702735158
Energy: 1.3626399850967932
Energy: 1.3596593992733628
Energy: 1.4220472180132673
Energy: 1.3629132446519316
Energy: 1.3612879039477488
Energy: 1.3605712417623523
Energy: 1.3659290565164806
Energy: 1.3626491180564384
Energy: 1.6116490690269738
Energy: 1.3277776182045176
Energy: 1.599713119840889
Energy: 1.3647129464755325
Energy: 1.361851107491655
Energy: 1.6016929478437447
Energy: 1.9223247570383317
Energy: 1.3230960951920008
Energy: 1.6013908383366489
Energy: 1.36419925449307
Energy: 1.3229615955210738
Energy: 1.6011932035858878
Energy: 1.3650740427874941
Energy: 1.3689030396690325
Energy: 1.6017860554158772
Energy: 1.3206442890156815
Energy: 1.3209074028854744
Energy: 1.5988198997269616
Energy: 1.3635758083834242
Energy: 1.366140697744279
Energy: 1.3641341780211114
Energy: 1.6110978406673866
Energy: 1.3627554084649884
Energy: 1.3602555410476385
Energy: 1.3589514877654774
Energy: 1.363533987628599
Energy: 1.3622172792365121
Energy: 1.326789373884341
Energy: 2.0040382514722928
Energy: 1.361100505613476
Energy: 1.3637792631894474
Energy: 1.3667398397153252
Energy: 1.363383052523785
Energy: 1.6124471395994435
Energy: 2.006428111796668
Energy: 1.3619711855755805
Energy: 1.3654618960839942
Energy: 1.4212927600536194
Energy: 1.3657078700623762
Energy: 1.6120576372691329
Energy: 1.3631609253551131
Energy: 1.3596347543240426
Energy: 1.359970721071995
Energy: 1.3620292700287973
Energy: 1.3633112742038127
Energy: 1.3284033669835258
Energy: 1.5758905790398738
Energy: 1.599341377015117
Energy: 1.3621912889655186
Energy: 1.367455790038348
Energy: 1.3610108896260702
Energy: 1.3262221166937391
Energy: 2.012140357391444
Energy: 1.8854846967861556
Energy: 1.3698459688207643
Energy: 1.4471783559414797
Energy: 1.6147921785188415
Energy: 1.6821681951199547
Energy: 1.3261912487444663
Energy: 1.3258615176954054
Energy: 1.8469378140251396
Energy: 1.3212294312526431
Energy: 1.6182189606163597
Energy: 1.3276927768575617
Energy: 1.334092963422236
Energy: 1.325683296780071
Energy: 1.6134203274663117
Energy: 1.7671418020584675
Energy: 1.3264836639030626
Energy: 1.324635724701314
Energy: 1.32180409871785
Energy: 1.3214078110081142
Energy: 1.3218292975310861
Energy: 1.4465310952172004
Energy: 1.3222033360609857
Energy: 1.3217127097585606
Energy: 1.3268670236983096
Energy: 1.324068900426396
Energy: 1.6150610007796766
Energy: 1.367840411849917
Energy: 1.3248303666140508
Energy: 1.323763164261357
Energy: 1.332842291482856
Energy: 1.325241029558889
Energy: 1.8465914111985675
Energy: 1.3623415620215331
Energy: 1.3212843218107946
Energy: 1.3645221473958142
Energy: 1.805687962646775
Energy: 1.6815291732126796
Energy: 1.682712476329773
Energy: 1.4215832495163117
Energy: 1.6164293473307685
Energy: 1.3258632849322953
Energy: 1.574902812973259
Energy: 1.6815649542003919
Energy: 1.36409723842976
Energy: 1.6034921652310623
Energy: 1.365013124394531
Energy: 1.3297961384294232
Energy: 1.591299168175646
Energy: 1.6429627915419425
Energy: 1.3609740927552767
Energy: 1.362158616398035
Energy: 1.3598699585480836
Energy: 1.325596402815682
Energy: 1.8110382626176982
Energy: 1.3601331463825688
Energy: 1.3626611815558507
Energy: 1.6049893435096483
Energy: 1.3614870382681068
Energy: 1.320094538684552

minimum gb energy = 1.3196325934361512 eV
minimum distance =  2.2798525222409 Angstroms
sigma value = 57


========================================
theta = 99.36891557845483
========================================

Energy: 2.382711010551503
Energy: 1.3702415744218406
Energy: 1.400379027054626
Energy: 1.4029633406387254
Energy: 1.4223127179553199
Energy: 1.3703866239841542
Energy: 1.4241791996821622
Energy: 1.3973638541930833
Energy: 1.398084552510553
Energy: 1.4083043674441573
Energy: 1.3975465978012815
Energy: 1.4005101403868931
Energy: 1.4705303183604002
Energy: 1.6227787479634048
Energy: 1.3982148700266577
Energy: 1.4034155744217818
Energy: 1.397260809883282
Energy: 1.45253880704403
Energy: 1.955994415588483
Energy: 1.9435684522097645
Energy: 1.3993141531417774
Energy: 1.3996943767965537
Energy: 1.3998124619659083
Energy: 1.7259318454612378
Energy: 1.7990470093379614
Energy: 1.7257155453895034
Energy: 1.6213175156825037
Energy: 1.349178729449663
Energy: 1.6153793017285196
Energy: 1.7250669315172578
Energy: 1.4123561757719691
Energy: 1.4201643377179165
Energy: 1.3496348112734124
Energy: 1.3532751846283322
Energy: 1.438618575608908
Energy: 1.4187170596498473
Energy: 1.427460163275847
Energy: 1.4151668438036993
Energy: 1.4417723800867952
Energy: 1.7874260528304577
Energy: 1.4160736692291398
Energy: 1.416148489334248
Energy: 1.4187077785736575
Energy: 1.4149810009370771
Energy: 1.4220116719845048
Energy: 1.4042393394638317
Energy: 1.4152095530907616
Energy: 1.4150659047439857
Energy: 1.4160458296921572
Energy: 1.4206721615787308
Energy: 1.71561295744743
Energy: 1.4150825256018766
Energy: 1.418422056395956
Energy: 1.420242784717759
Energy: 1.4434851791468888
Energy: 1.4174526411125514
Energy: 1.6597374592513452
Energy: 1.628346566314571
Energy: 1.6585973668334202
Energy: 1.4191712466585433
Energy: 1.6097188912905322
Energy: 1.6374835965301917
Energy: 1.3125081040327238
Energy: 1.5398722888800904
Energy: 1.6455153020198239
Energy: 1.639909743715871
Energy: 1.4284207679524779
Energy: 1.6557358167825664
Energy: 1.3132133452683667
Energy: 1.3160049940235448
Energy: 1.6560520244247185
Energy: 1.4347842052127702
Energy: 1.4718333848060188
Energy: 1.3103553146414635
Energy: 1.311475995298821
Energy: 1.3143057562916616
Energy: 1.314310940551148
Energy: 1.4366731788093858
Energy: 2.1124293881106295
Energy: 1.3114308168369233
Energy: 1.3189037310812384
Energy: 1.3974413665035512
Energy: 1.3126469368017695
Energy: 1.9715359591354882
Energy: 1.448615670776544
Energy: 1.3108679335938622
Energy: 1.3127480460029197
Energy: 1.3151011213159505
Energy: 1.3117110093670148
Energy: 1.3104242930575891
Energy: 1.4261755483131255
Energy: 1.315393207620364
Energy: 1.3111364269833248
Energy: 1.523606924050744
Energy: 1.3113204277729908
Energy: 1.4364694412742391
Energy: 1.952970060598446
Energy: 1.9146585014956765
Energy: 1.3108244597986844
Energy: 1.5270516172840125
Energy: 1.3196764695624692
Energy: 1.7231182942956338
Energy: 1.4382122673028206
Energy: 1.9142974229475447
Energy: 1.6070042456303886
Energy: 1.4089782325289963
Energy: 1.6171703102401993
Energy: 1.7230375014938053
Energy: 1.4149155518512748
Energy: 1.4188994257961924
Energy: 1.6027388420611177
Energy: 1.5716717489127807
Energy: 1.4353879066887698
Energy: 1.4184552269867674
Energy: 1.428017099840467
Energy: 1.4169975120470453
Energy: 1.6107075666317334
Energy: 1.8039498802459013
Energy: 1.4172964941583637
Energy: 1.417982906878239
Energy: 1.4182884822745914
Energy: 1.4153273862015188
Energy: 1.415276305637927
Energy: 1.4241271088954097
Energy: 1.4160401221245764
Energy: 1.4154108042045919
Energy: 1.4165248704238558
Energy: 1.421314812477161
Energy: 1.7144638274814787
Energy: 1.4076644653711545
Energy: 1.418697757862375
Energy: 1.4198592202260125
Energy: 1.474609397873552
Energy: 1.4196748272239326
Energy: 1.6665348609749508
Energy: 1.4094709513490336
Energy: 1.6497206181009159
Energy: 1.4194793175782725
Energy: 1.6097896317331832
Energy: 1.7309653999085395
Energy: 1.4007079803456703
Energy: 1.418078855767907
Energy: 1.6483568600606051
Energy: 1.415906164756509
Energy: 1.4726368742300344
Energy: 1.652148152954583
Energy: 1.3972026331496596
Energy: 1.3984061760990063
Energy: 1.7392000232866631
Energy: 1.4190206056997428
Energy: 1.4449518314358096
Energy: 1.3994581916464297
Energy: 1.3987759156678206
Energy: 1.4034680402685145
Energy: 1.3996579148683015
Energy: 1.4210062311770926
Energy: 1.965989699693003
Energy: 1.738351264064859
Energy: 1.4094840710789482
Energy: 1.415587069072341
Energy: 1.39650428622232
Energy: 1.6867539959312363

minimum gb energy = 1.3103553146414635 eV
minimum distance =  2.21044968426696 Angstroms
sigma value = 43


========================================
theta = 102.11511746203723
========================================

Energy: 2.684105318476615
Energy: 1.4014049590500137
Energy: 1.4211530405825785
Energy: 1.420628597891134
Energy: 1.420777492936243
Energy: 1.417085098466498
Energy: 1.45989465660786
Energy: 1.4208180601936609
Energy: 1.4212927490926464
Energy: 1.4196955493682546
Energy: 1.4214083905549377
Energy: 1.6936010011912306
Energy: 1.733057889749949
Energy: 1.4836016967197005
Energy: 1.4196698539645725
Energy: 1.4250455164487545
Energy: 1.4200609250846845
Energy: 1.4240922463935426
Energy: 1.604024037819825
Energy: 1.936007163808188
Energy: 1.4199394419882692
Energy: 1.4183396940705082
Energy: 1.4266069052840813
Energy: 1.3708635038342658
Energy: 1.7363159233439993
Energy: 1.3718439103830817
Energy: 1.6888028020022077
Energy: 1.4678249821551188
Energy: 1.6889490514603327
Energy: 1.3725889016675046
Energy: 1.3726148227127193
Energy: 1.3734546847277762
Energy: 1.971213414020664
Energy: 1.3679715153762944
Energy: 1.3725319969864085
Energy: 1.3735269252246027
Energy: 1.3767567393194984
Energy: 1.37192483014812
Energy: 1.6891768511680834
Energy: 1.4240586426777109
Energy: 1.3719697063832306
Energy: 1.3722132591093974
Energy: 1.3768037623312523
Energy: 1.3705948600401408
Energy: 1.4778593142573615
Energy: 1.4189552371059588
Energy: 1.3711587615368803
Energy: 1.370474314434542
Energy: 1.3744323177993172
Energy: 1.3730095381744973
Energy: 1.4793597657233932
Energy: 1.3681016264545345
Energy: 1.371614715740381
Energy: 1.3734277516230327
Energy: 1.863836438449361
Energy: 1.371755768775045
Energy: 1.6947044254757198
Energy: 1.5320421091292218
Energy: 1.6891299716078647
Energy: 1.3726137515342156
Energy: 1.9846337624925516
Energy: 1.6909095672269763
Energy: 1.4206373412206368
Energy: 1.422102114632504
Energy: 1.4218305237696853
Energy: 1.3686689331232016
Energy: 1.7291076148409734
Energy: 1.3727306796010745
Energy: 1.4205480176570007
Energy: 1.4285798729192225
Energy: 1.421088577588672
Energy: 1.3735706831879375
Energy: 1.4170878780388894
Energy: 1.4209313182230685
Energy: 1.4203852190406252
Energy: 1.4243528577699132
Energy: 1.419892797050245
Energy: 1.5767641599823685
Energy: 1.7275482649185387
Energy: 1.4247790990942886
Energy: 1.4261158499654738
Energy: 1.4210686362542913
Energy: 1.4274970565979401
Energy: 1.3677735214540274
Energy: 1.5261148926161043
Energy: 1.693508333703167
Energy: 1.4216823199427056
Energy: 1.4202311608019769
Energy: 1.420627826015813
Energy: 1.4198440910756425
Energy: 1.729341659159135
Energy: 1.5761400693238692
Energy: 1.4197198614034587
Energy: 1.4245440103111784
Energy: 1.6920070151490205
Energy: 1.419197350374353
Energy: 1.7326825864935138
Energy: 1.419459782171316
Energy: 1.4230108955016119
Energy: 1.5338644230064342
Energy: 1.5893774065688835
Energy: 1.4195664365958218
Energy: 1.7344899933584492
Energy: 1.4204024875006043
Energy: 1.4200355751001688
Energy: 1.470664885803759
Energy: 1.69389304074543
Energy: 1.4205574140599149
Energy: 1.4206488459520918
Energy: 1.4209431003649886
Energy: 1.4014116670669718
Energy: 1.4172837509665073
Energy: 1.4524573469538524
Energy: 1.4204212412592745
Energy: 1.4268785002784405
Energy: 1.4209113351251028
Energy: 1.6935513232419726
Energy: 1.3727909320813854
Energy: 1.4212308389807298
Energy: 1.4214518417175779
Energy: 1.42371362778303
Energy: 1.4198514981200363
Energy: 1.371936653836624
Energy: 1.4541079270504975
Energy: 1.421309517304203
Energy: 1.4197154752193308
Energy: 1.4180671236438216
Energy: 1.4206328610523704
Energy: 1.3718923658830917
Energy: 1.371238431527829
Energy: 1.9362632003681541
Energy: 1.4202259038604117
Energy: 1.4669165600909868
Energy: 1.6889822198968252
Energy: 1.372285546986828
Energy: 1.4200372214976675
Energy: 1.3719936194101645
Energy: 1.6947711390951297
Energy: 1.9826179697687558
Energy: 1.3722347977001288
Energy: 1.3734003746533379
Energy: 1.3726358478702019
Energy: 1.378431852886388
Energy: 1.9677803823869984
Energy: 1.4239934609406155
Energy: 1.3712348252254198
Energy: 1.3721056073728428
Energy: 1.374285301619073
Energy: 1.3716866601716036
Energy: 1.4691465733032945
Energy: 1.424481211740345
Energy: 1.6894632970572103
Energy: 1.3706835693903008
Energy: 1.3724851450475015
Energy: 1.3706473720092052
Energy: 1.461920029559318
Energy: 1.7275061407135592
Energy: 1.945562973846805
Energy: 1.373410451710459
Energy: 1.3747325030860504
Energy: 1.372572967816146
Energy: 1.3675099244111666
Energy: 1.7708657339244729
Energy: 1.6890436545008465
Energy: 1.3725574124076463
Energy: 1.424844935168651
Energy: 1.3722128549960508
Energy: 1.6942720778140399
Energy: 1.4219065137247506
Energy: 1.4224619969581571
Energy: 1.3758696235399976
Energy: 1.3700580845880295
Energy: 1.9370851132812217
Energy: 1.4228577179034694
Energy: 1.4274090692506813
Energy: 1.4206953808541607
Energy: 1.37200321287891
Energy: 1.7286544076495722
Energy: 1.4212776974941026
Energy: 1.4206516523315096
Energy: 1.4234537175415278
Energy: 1.4201633055975396
Energy: 1.6922850614429492
Energy: 1.4181075204106308
Energy: 1.4204894709468585
Energy: 1.4205082836304352
Energy: 1.4212519068745342
Energy: 1.4275099239933997
Energy: 1.3710581023270838
Energy: 1.911978664499373
Energy: 1.4252117520376184
Energy: 1.427124138666349
Energy: 1.7359468530191973
Energy: 1.4210303297851674
Energy: 1.693168453743435
Energy: 1.5283011395694026
Energy: 1.4199929051938793
Energy: 1.4213775473600223
Energy: 1.4707849082415534
Energy: 1.420254514811461
Energy: 1.4199758598912617
Energy: 1.7289212705294241
Energy: 1.5906541314364242
Energy: 1.4195718419464929
Energy: 1.7334907741696306
Energy: 1.4226221701900523
Energy: 1.4196579235120572
Energy: 1.424819407273954
Energy: 1.4188441547826647
Energy: 1.4249935581895516
Energy: 1.4708025669144513
Energy: 1.6938216131669404
Energy: 1.420982505844814
Energy: 1.4230331636676739
Energy: 1.4210366322163313
Energy: 1.7467313633843926

minimum gb energy = 1.3675099244111666 eV
minimum distance =  2.24467807724972 Angstroms
sigma value = 81


========================================
theta = 109.47122063449069
========================================

Energy: 1.392406424624237
Energy: 1.3922239193076016
Energy: 1.3969404991585028
Energy: 1.3977328028135103
Energy: 1.7996197550381023
Energy: 1.3917656584683356
Energy: 1.3919617403064457
Energy: 1.5299728693595624
Energy: 1.3975683386674114
Energy: 1.3978720947231973
Energy: 1.3949955658851707
Energy: 1.5301210911567418
Energy: 1.5319464034143944
Energy: 1.5301524531484338
Energy: 1.397401986901206
Energy: 1.3971410652508263
Energy: 1.3980281694846644
Energy: 1.530660112192058
Energy: 1.5294764189104857
Energy: 1.5300111414312259
Energy: 1.397583387391258
Energy: 1.3950500061298403
Energy: 1.5299592211567021
Energy: 1.5301767619041806
Energy: 1.529587836724226
Energy: 1.5323920974730845
Energy: 1.5295454683992316
Energy: 1.3918719721551516
Energy: 1.5318357060680188
Energy: 1.529993629614493
Energy: 1.3978300205560361
Energy: 1.3980418679810693
Energy: 1.3917887159005928
Energy: 1.3940637506264575
Energy: 1.5299212038347088
Energy: 1.3980608598669648
Energy: 1.3979970990799302
Energy: 1.39452940422253
Energy: 1.5300081363494678
Energy: 1.5299384661156572
Energy: 1.5317768776857752
Energy: 1.3977360528811908
Energy: 1.3971647908708311
Energy: 1.3976305615866123
Energy: 1.5299976618675613
Energy: 1.5301932047615625
Energy: 1.529837342695222
Energy: 1.397668775086165
Energy: 1.3969767744723343
Energy: 1.3976866067519942
Energy: 1.5299737083868121
Energy: 1.5297128991486038
Energy: 1.529918413609398
Energy: 1.3976505113342024
Energy: 1.3918430102688124
Energy: 1.5302084017367572
Energy: 1.53034342621228
Energy: 1.5295174658263497
Energy: 1.5312736308850414
Energy: 1.5301275815987672

minimum gb energy = 1.3917656584683356 eV
minimum distance =  2.28799036325031 Angstroms
sigma value = 3


========================================
theta = 117.56060310526324
========================================

Energy: 2.539257570432748
Energy: 1.382073493374737
Energy: 1.3561596702641665
Energy: 1.3563987865196574
Energy: 1.3588747318874799
Energy: 1.4232506306659602
Energy: 1.8082291293093986
Energy: 1.3570681601651096
Energy: 1.5881739128866874
Energy: 1.588270713348112
Energy: 1.591392778594277
Energy: 1.592395662036574
Energy: 1.5928949359988198
Energy: 1.4584941118560422
Energy: 1.590980131493343
Energy: 1.589365974353449
Energy: 1.591813156987485
Energy: 1.588374689606748
Energy: 1.586808140708386
Energy: 1.5907458943648474
Energy: 1.5883457746298475
Energy: 1.5882775811261565
Energy: 1.4577636111043852
Energy: 1.5906191599270278
Energy: 1.5902028720138284
Energy: 1.5883678247045703
Energy: 1.5942097761423344
Energy: 1.67176627122892
Energy: 1.5947996990958924
Energy: 1.5892394200253677
Energy: 1.6530306095798404
Energy: 1.6297681636609567
Energy: 1.459316981303509
Energy: 1.3506601110805534
Energy: 1.5909191699409921
Energy: 1.6300852416301244
Energy: 1.8086559671154354
Energy: 1.59172259462573
Energy: 1.5917594231705596
Energy: 1.355976243637091
Energy: 1.591568701613295
Energy: 1.5899836178585411
Energy: 1.8053797386577275
Energy: 1.5913416610718683
Energy: 1.3593665531069719
Energy: 1.3570717262227636
Energy: 1.3575603947731465
Energy: 1.591423522010954
Energy: 1.5872274698359277
Energy: 1.3559299502494409
Energy: 1.3554643212985849
Energy: 1.3567681993730802
Energy: 1.355698847402152
Energy: 1.6690807532343162
Energy: 1.6519175912959612
Energy: 1.464501563737027
Energy: 1.3570625453703111
Energy: 1.3567685938763911
Energy: 1.3582210958430427
Energy: 1.4647903699359934
Energy: 1.7814884331602543
Energy: 1.4654919078128932
Energy: 1.357851149499338
Energy: 1.3581821210379337
Energy: 1.356504625498505
Energy: 1.5857746807524842
Energy: 1.411443444787775
Energy: 1.4648986737458818
Energy: 1.3574133196320486
Energy: 1.7679143983611425
Energy: 1.3570068934611292
Energy: 1.3909262711848274
Energy: 1.3558862357487615
Energy: 1.356015589229317
Energy: 1.356612975921677
Energy: 1.7604931691919656
Energy: 1.3569567482124136
Energy: 1.3565116719193555
Energy: 1.3553083364853953
Energy: 1.3554881169677107
Energy: 1.357322204175582
Energy: 1.653677895022147
Energy: 1.3558036553696655
Energy: 1.3544859552565807
Energy: 1.3583901890519345
Energy: 1.3561825301917234
Energy: 1.591558938344304
Energy: 1.813735272356642
Energy: 1.4424736606428823
Energy: 1.3568027983938202
Energy: 1.3587034237179099
Energy: 1.6597694615564125
Energy: 1.5913220076462091
Energy: 1.5910316231786266
Energy: 1.590907064863113
Energy: 1.3562244144697662
Energy: 1.7579326978683443
Energy: 1.3567992426223405
Energy: 1.5892747958903959
Energy: 1.629385172144078
Energy: 1.5887375641985795
Energy: 1.3447874171969727
Energy: 1.5607936709033465
Energy: 1.3578560991213209
Energy: 1.5893365434499431
Energy: 1.5891880685939765
Energy: 1.5941314197187264
Energy: 1.4455703525835055
Energy: 1.5891012235592255
Energy: 1.4606779280533089
Energy: 1.5904307316994093
Energy: 1.589430111472762
Energy: 1.5903352097832495
Energy: 1.5890438192923566
Energy: 1.593256396932422
Energy: 1.5911329367277534
Energy: 1.591279327220973
Energy: 1.5887857506625123
Energy: 1.4727252887202453
Energy: 1.5889720394998448
Energy: 1.5903933695114343
Energy: 1.5911744610745098
Energy: 1.3571129787186769
Energy: 1.3570127656861752
Energy: 1.5916302161981577
Energy: 1.5905627543082896
Energy: 1.5879377742382725
Energy: 1.5891219812839357
Energy: 1.4600262382356555
Energy: 1.3507244129924973
Energy: 1.5894799374264776
Energy: 1.588367071295813
Energy: 1.589200220656467
Energy: 1.5890065555373625
Energy: 1.669363073558562
Energy: 1.6713287385485023
Energy: 1.5944331610526759
Energy: 1.5904654605240771
Energy: 1.81299965959863
Energy: 1.6598720537449063
Energy: 1.356860610203361
Energy: 1.3564462675970517
Energy: 1.4358919282622704
Energy: 1.8122233961384222
Energy: 1.5891048018790852
Energy: 1.4430856815337167
Energy: 1.3563409802787267
Energy: 1.3565395719135838
Energy: 1.3561881827595492
Energy: 1.5902647974205353
Energy: 1.6529631982984363
Energy: 1.3575896143790904
Energy: 1.3573161778078033
Energy: 1.3548183610307587
Energy: 1.3574038399031645
Energy: 1.4659803836174452
Energy: 1.7804309967005614
Energy: 1.4668136100835076
Energy: 1.35838142237695
Energy: 1.3593472177631094
Energy: 1.3581875375183288
Energy: 1.585716478036414
Energy: 1.652770283965913
Energy: 1.454647581561065
Energy: 1.3594124228467996
Energy: 1.3617703777147063
Energy: 1.4641467915092998
Energy: 1.4540313228654462
Energy: 1.3561172631239247
Energy: 1.358205371530914
Energy: 1.3620276199824954
Energy: 1.367456909476092
Energy: 1.4643186175235476
Energy: 1.357014268885933
Energy: 1.3564789452119002
Energy: 1.3570644979899686
Energy: 1.3574117318199894
Energy: 1.4009295954545353
Energy: 1.3573896011069575
Energy: 1.3559742867695401
Energy: 1.3557489681928212
Energy: 1.3559953059370793
Energy: 1.5882930816718601
Energy: 1.590088625475501
Energy: 1.3559304343782967
Energy: 1.3561465311049605
Energy: 1.3586204234624908
Energy: 1.3573627657164782
Energy: 1.6604929124812013
Energy: 1.591658247480897
Energy: 1.6600910518091923
Energy: 1.3568977252582277
Energy: 1.7896053698632117
Energy: 1.3563491252006283
Energy: 1.5885076321276288
Energy: 1.5895671765368964
Energy: 1.5943443095923377
Energy: 1.4574091167442722

minimum gb energy = 1.3447874171969727 eV
minimum distance =  2.26961838367459 Angstroms
sigma value = 67


========================================
theta = 121.00758300686714
========================================

Energy: 2.1465117778772584
Energy: 1.3283745756993028
Energy: 1.4599934410193924
Energy: 1.6703775387373971
Energy: 1.2870095891982247
Energy: 1.3272594683557988
Energy: 1.4487433506543854
Energy: 1.5336745093874569
Energy: 1.6200688860866783
Energy: 1.6223470543924863
Energy: 1.6184154493214196
Energy: 1.5431561487843553
Energy: 1.6110164452811537
Energy: 1.3906092459769919
Energy: 1.6305984432842615
Energy: 1.6211447294839474
Energy: 1.287178647751083
Energy: 1.6114916095874499
Energy: 1.608761774664752
Energy: 1.620980020565524
Energy: 1.5349406756479838
Energy: 1.6021673703343946
Energy: 1.3801822240945432
Energy: 1.626052277196223
Energy: 1.6199183656534988
Energy: 1.6089338959248167
Energy: 1.6222981139937416
Energy: 1.2925697066300013
Energy: 1.6209278054422112
Energy: 1.6107870231013899
Energy: 1.3501640096634293
Energy: 1.6408354018233697
Energy: 1.5135876640484849
Energy: 1.4526121161660261
Energy: 1.6108384402986817
Energy: 1.3477724565791214
Energy: 1.8639086816720272
Energy: 1.6093742983418098
Energy: 1.8041970817261148
Energy: 1.2885985763114614
Energy: 1.8045718470008505
Energy: 1.6076766566343248
Energy: 1.8659990980779593
Energy: 1.6217283892209449
Energy: 1.440753189887686
Energy: 1.4391110855247038
Energy: 1.4417946648039628
Energy: 1.7432417137091847
Energy: 1.779013390767501
Energy: 1.4444453918263054
Energy: 1.444959701694651
Energy: 1.4433135346161614
Energy: 1.4454364675777043
Energy: 1.7673108175095948
Energy: 1.64246362710118
Energy: 1.3616234223085986
Energy: 1.441955314994478
Energy: 1.4445544098715695
Energy: 1.2875977682645083
Energy: 1.2878142222736795
Energy: 1.441757863435483
Energy: 1.3588227246714826
Energy: 1.2881126162958842
Energy: 1.4401398872101874
Energy: 1.3594670432504872
Energy: 1.286196446933589
Energy: 1.3749583968406127
Energy: 1.2865370950731831
Energy: 1.286180869741366
Energy: 1.2871832503343998
Energy: 1.357851326166696
Energy: 1.3184858222475837
Energy: 1.443748741637299
Energy: 1.2866972704139272
Energy: 1.2868624208202233
Energy: 1.2880286677750161
Energy: 1.2876685244021673
Energy: 1.2864374265853984
Energy: 1.4400507766566146
Energy: 1.2879711506503448
Energy: 1.3601658562804946
Energy: 1.7351505516338275
Energy: 1.2866251620054525
Energy: 1.286934907799578
Energy: 1.3166542796670808
Energy: 1.2879153318458558
Energy: 1.7396674682793913
Energy: 1.7447193976886037
Energy: 1.3590055359057072
Energy: 1.2875686114604337
Energy: 1.4393331358513175
Energy: 1.749936458119933
Energy: 1.7490841541892774
Energy: 1.7376443971595967
Energy: 1.7493831795587798
Energy: 1.438510700974814
Energy: 1.5725141150519975
Energy: 1.6854575985032438
Energy: 1.7348461807600408
Energy: 1.7414861549704692
Energy: 1.734859106451229
Energy: 1.4468628848822198
Energy: 1.5748159534810884
Energy: 1.68544012356625
Energy: 1.7347593102044165
Energy: 1.6110946558472394
Energy: 1.7350905460779342
Energy: 1.3147033543508795
Energy: 1.3164639098782194
Energy: 1.31614484848833
Energy: 1.762961510062944
Energy: 1.74778196399029
Energy: 1.6726344989074964
Energy: 1.3161240708566857
Energy: 1.3244008045758768
Energy: 1.316016023450268
Energy: 1.6830782374059614
Energy: 1.6118243230736886
Energy: 1.3163355399610914
Energy: 1.3154084414779528
Energy: 1.3184429613002506
Energy: 1.3160317188818123
Energy: 1.5186443388879498
Energy: 1.6223266233764362
Energy: 1.3151558025551848
Energy: 1.3154108034012255
Energy: 1.3147263955702275
Energy: 1.3164486492078702
Energy: 1.6341301969098982
Energy: 1.6210647930119417
Energy: 1.3580809607109836
Energy: 1.3153948169075127
Energy: 1.4476791013245605
Energy: 1.5143189710504479
Energy: 1.6175757867703604
Energy: 1.6279446459552027
Energy: 1.6186084482499377
Energy: 1.6865275289799186

minimum gb energy = 1.286180869741366 eV
minimum distance =  2.20904635507376 Angstroms
sigma value = 33


========================================
theta = 124.1232945407953
========================================

Energy: 2.650908830515494
Energy: 1.2136692726034917
Energy: 1.393249409390309
Energy: 1.39137563291709
Energy: 1.3894652600067956
Energy: 1.2182968488066472
Energy: 1.5613714305631896
Energy: 1.4589802426377085
Energy: 1.7193510265200111
Energy: 1.721965140633587
Energy: 1.4552609063433042
Energy: 1.7824924791819905
Energy: 1.3913569534665564
Energy: 1.2128448464170878
Energy: 1.7814117169260668
Energy: 1.5694831372255056
Energy: 1.4542648059256962
Energy: 1.3898782640543432
Energy: 1.3923733305875121
Energy: 1.3952629904772034
Energy: 1.4616576314072336
Energy: 1.7196951481969662
Energy: 1.2132760185870473
Energy: 1.3955127338127273
Energy: 1.3900560025977644
Energy: 1.3886501349415656
Energy: 1.283994492599535
Energy: 1.390288822925644
Energy: 1.3919381971623876
Energy: 1.3898162304136592
Energy: 1.39717716339151
Energy: 1.2135328594120305
Energy: 1.6387907729527391
Energy: 1.7148232102597567
Energy: 1.2125557093324382
Energy: 1.3966412638674732
Energy: 1.843850432396225
Energy: 1.3934210766471034
Energy: 1.642827759576979
Energy: 1.2209831157390414
Energy: 1.2123875534166488
Energy: 1.5619183781175918
Energy: 1.2101539224934064
Energy: 1.285412909997144
Energy: 1.3908673035064076
Energy: 1.395001851106855
Energy: 1.3909450088338369
Energy: 1.5738233702351248
Energy: 1.3902050726824808
Energy: 1.3951422242932119
Energy: 1.3952035236278026
Energy: 1.3908390130675863
Energy: 1.3951823812664899
Energy: 1.3927933438786504
Energy: 1.7213511395165801
Energy: 1.4571284513882652
Energy: 1.3915907279435062
Energy: 1.3930471026905924
Energy: 1.2129912363164528
Energy: 1.7210329796805777
Energy: 1.7204133692769064
Energy: 1.7818094182025739
Energy: 1.3911008942533927
Energy: 1.3909692735559118
Energy: 1.4542816949892963
Energy: 1.783128276976453
Energy: 1.7170381312047758
Energy: 1.7191703094582225
Energy: 1.2138917234536784
Energy: 1.3863082777739453
Energy: 1.2135435992677637
Energy: 1.7180355564179395
Energy: 1.5446751502526823
Energy: 1.718662516104634
Energy: 1.2142275415785637
Energy: 1.3865152625092252
Energy: 1.2133457004498003
Energy: 1.7255820313665104
Energy: 1.8478531709138415
Energy: 1.7822536910204394
Energy: 1.2134524170207324
Energy: 1.2130449619987862
Energy: 1.2128799069674094
Energy: 1.9821952006590022
Energy: 1.8449118735780283
Energy: 1.2151311132091358
Energy: 1.2121455039457245
Energy: 1.2145318737777762
Energy: 1.2122051051202267
Energy: 1.3892589906332644
Energy: 1.5437493580520611
Energy: 1.2124331382044888
Energy: 1.2117840975540153
Energy: 1.212531616460323
Energy: 1.2115059584964718
Energy: 1.5341295645159012
Energy: 1.7133948088108224
Energy: 1.2126048309208879
Energy: 1.2122259085144684
Energy: 1.2148424960312951
Energy: 1.2127204297909027
Energy: 1.784830441962633
Energy: 1.8474864865689844
Energy: 1.4540501758808302
Energy: 1.7830491138308036
Energy: 1.2134646682567247
Energy: 1.2124074232776483
Energy: 1.7227934136220917
Energy: 1.7256833352502583
Energy: 1.7229346479947913
Energy: 1.2102409347878682
Energy: 1.5714775291695187
Energy: 1.5314872398805157
Energy: 1.7238883428129683
Energy: 1.7207490671484555
Energy: 1.7190740338085024
Energy: 1.2127481748413107
Energy: 1.5610434863472744
Energy: 1.4642819140774903
Energy: 1.7212280677982865
Energy: 1.561002240250488
Energy: 1.7817089324371214
Energy: 1.389054919905385
Energy: 1.3934784377050347
Energy: 1.286320612688443
Energy: 1.782855983165509
Energy: 1.7196408409858897
Energy: 1.2874675546143615
Energy: 1.3956627512259603
Energy: 1.3926586443592774
Energy: 1.395554277149689
Energy: 1.7175716990924415
Energy: 1.389824249529038
Energy: 1.393979022623525
Energy: 1.3894874062326195
Energy: 1.38943428438171
Energy: 1.3895441240516353
Energy: 1.6420236306630251
Energy: 1.5399159806713183
Energy: 1.2144867106323
Energy: 1.395585076440311
Energy: 1.3888409188545427
Energy: 1.3962964974737244
Energy: 1.646492946146814
Energy: 1.3906138747578014
Energy: 1.390383677249149
Energy: 1.3897274230867205
Energy: 1.3901838499716337
Energy: 1.3912241831262475
Energy: 1.6390478446144543
Energy: 1.3968404788735027
Energy: 1.3912807983421234
Energy: 1.5738744597266732
Energy: 1.8449315426997768
Energy: 1.213139487812017
Energy: 1.3910643632355681
Energy: 1.3902357770540081
Energy: 1.3953765649665588
Energy: 1.2129501094629769
Energy: 1.5659606142766491
Energy: 1.395537266367792
Energy: 1.39165372439473
Energy: 1.3905924882087815
Energy: 1.395198072957025
Energy: 1.46045777260806
Energy: 1.721467968657244
Energy: 1.2873599394081372
Energy: 1.391704952989781
Energy: 1.3902917550860086
Energy: 1.289124012602239
Energy: 1.787081954712792
Energy: 1.7206042877617753
Energy: 1.7812729502068723
Energy: 1.39056749616749
Energy: 1.3853115973957821
Energy: 1.2129098734141097
Energy: 1.7197138717506804
Energy: 1.71850916150529
Energy: 1.7201060584104781
Energy: 1.3872301444542847
Energy: 1.3861284765693354
Energy: 1.2135510541909096
Energy: 1.531665344701336
Energy: 1.544292260547454
Energy: 1.7182387310820397
Energy: 1.3876858687053697
Energy: 1.213689497968852
Energy: 1.3894986515330758
Energy: 1.7814822282539606
Energy: 1.844202576603015
Energy: 1.7817623562162619
Energy: 1.213307445485714
Energy: 1.215052926721725
Energy: 1.21237202940826
Energy: 1.284098991093727
Energy: 1.844829346383969
Energy: 1.2141048594305859
Energy: 1.2125527552795714
Energy: 1.210596131941207
Energy: 1.2113794099690818
Energy: 1.212415070049157
Energy: 1.848835739315361
Energy: 1.2118631623547174
Energy: 1.211956340740243
Energy: 1.2135466718910517
Energy: 1.212697151735765
Energy: 1.454455618288189
Energy: 1.5437284890684468
Energy: 1.2129990186752664
Energy: 1.21289369343778
Energy: 1.213497259066596
Energy: 1.7805963113534917
Energy: 1.7165652424444757
Energy: 1.5435801596896666
Energy: 1.4548404387453315
Energy: 1.3890490585905224
Energy: 1.2126727301880542
Energy: 1.4626890774771462
Energy: 1.5316407092272353
Energy: 1.725660801707387
Energy: 1.5317114695144336
Energy: 1.5706993537593714

minimum gb energy = 1.2101539224934064 eV
minimum distance =  2.22495144848703 Angstroms
sigma value = 41


========================================
theta = 129.5211963586422
========================================

Energy: 2.046014498338371
Energy: 2.01995619179289
Energy: 1.388863796426624
Energy: 1.3927668227618457
Energy: 1.388930297005417
Energy: 2.019058602362805
Energy: 1.7916115347307828
Energy: 1.0442271732255823
Energy: 1.0417990871918446
Energy: 1.394902024214232
Energy: 1.0447906702212937
Energy: 1.3927533132816974
Energy: 1.400445338927525
Energy: 1.0452095652433198
Energy: 1.041819227601746
Energy: 0.9768085809401027
Energy: 1.0449904825383827
Energy: 1.3936292485441177
Energy: 1.3927670246802255
Energy: 1.5112334409768813
Energy: 1.0414912602436173
Energy: 1.3988216799966284
Energy: 1.0448646085201694
Energy: 1.5117545004721646
Energy: 1.4000386191441525
Energy: 1.3934416226335706
Energy: 1.041718894355063
Energy: 1.3957635857346737
Energy: 1.0439705847727208
Energy: 1.3936423474754491
Energy: 1.3898560108068
Energy: 1.3885842045213008
Energy: 1.9531662360218451
Energy: 1.3821959944356226
Energy: 1.953476524147714
Energy: 1.3891506436474463
Energy: 1.7916924783648032
Energy: 1.39723721810538
Energy: 1.3900700166238786
Energy: 1.396820055196251
Energy: 1.0430833878664652
Energy: 1.7925842522335667
Energy: 1.7913599470285488
Energy: 1.0450903398667764
Energy: 1.3901044201104236
Energy: 1.3918450535728712
Energy: 1.0450765356662164
Energy: 1.792660985883205
Energy: 1.393217494771697
Energy: 1.0457051883123232
Energy: 1.0418505887679275
Energy: 0.9769297185200521
Energy: 1.0446619615178514
Energy: 1.3891053768715282
Energy: 1.392845938362407
Energy: 1.0452565235680025
Energy: 1.0459182159655112
Energy: 1.3918803863423552
Energy: 1.0453204041403379
Energy: 1.3961912887828276
Energy: 1.393416719259042
Energy: 1.5116463090618755
Energy: 1.0465604249385965
Energy: 1.3944983529634372
Energy: 1.0446272270161303
Energy: 1.3947629970050663
Energy: 1.390176747692156
Energy: 1.390961382786645
Energy: 1.0453025965910319
Energy: 1.3819277765273024
Energy: 1.0429043513366796
Energy: 1.3908622076554686
Energy: 1.393770085927588
Energy: 1.390752882910167
Energy: 1.0455371749872566
Energy: 1.3908136928234776
Energy: 1.0437719264573528
Energy: 1.390417393019218
Energy: 1.7905364865172366
Energy: 1.5108743469852506
Energy: 1.3893694900634619
Energy: 1.3925116254849372
Energy: 1.3901494439787592
Energy: 2.019181048518398

minimum gb energy = 0.9768085809401027 eV
minimum distance =  2.26566104392803 Angstroms
sigma value = 11


========================================
theta = 135.99657265110037
========================================

Energy: 2.471761630552403
Energy: 1.3478338908898422
Energy: 1.358526064304617
Energy: 1.5647782491152746
Energy: 1.562434388917951
Energy: 2.2361000295782025
Energy: 1.3504962986812914
Energy: 1.3645072490725378
Energy: 1.350545737223698
Energy: 1.3506258134210432
Energy: 1.4363804876000987
Energy: 1.3645415232643583
Energy: 1.3671282266681062
Energy: 1.365305875406816
Energy: 1.434320690533821
Energy: 1.35102717180017
Energy: 1.4344383573648647
Energy: 1.3643776037676865
Energy: 1.363051995746358
Energy: 1.3651651473937847
Energy: 1.4367170246938425
Energy: 1.350079156335227
Energy: 1.3636143351403855
Energy: 1.365905568287518
Energy: 1.3636374116252983
Energy: 1.3655350592410247
Energy: 1.5216807231002745
Energy: 1.4887903431377996
Energy: 1.366104056033494
Energy: 1.3660740581610908
Energy: 1.363976613203596
Energy: 1.36410034089696
Energy: 1.567410671230193
Energy: 1.4894206677889126
Energy: 1.5701804208732002
Energy: 1.365073795579426
Energy: 1.3506459259748018
Energy: 1.3655620586052577
Energy: 1.352591003816271
Energy: 1.3513413607795701
Energy: 1.3526459734968856
Energy: 1.3490657886583375
Energy: 1.3518622794825208
Energy: 1.5211685657130483
Energy: 1.3426374633618197
Energy: 1.3431715365083003
Energy: 1.3423616828140417
Energy: 1.4818550447817178
Energy: 1.3645648743064573
Energy: 1.363964551785225
Energy: 1.4186514237517835
Energy: 1.3480883536263903
Energy: 1.5251181429344929
Energy: 1.364288780077023
Energy: 1.3644703227341153
Energy: 1.3661282010348859
Energy: 1.5231026901839462
Energy: 1.3486790302407496
Energy: 1.3638535989424758
Energy: 1.3648865832564403
Energy: 1.365076057256482
Energy: 1.365175752987861
Energy: 1.4205268135223903
Energy: 1.3427989866915224
Energy: 1.4183880156506183
Energy: 1.3655847307123081
Energy: 1.3652818605986747
Energy: 1.365822259438186
Energy: 1.343081901855713
Energy: 1.342771540584917
Energy: 1.3457803170360265
Energy: 1.4549192067530554
Energy: 1.4642329153058027
Energy: 1.3432886176801224
Energy: 1.3440610802288635
Energy: 1.3427171066559331
Energy: 1.343300621525812
Energy: 1.456171744616089
Energy: 1.3493578055611326
Energy: 1.3428968944641617
Energy: 1.3425010011146685
Energy: 1.343695873191026
Energy: 1.3427850583759535
Energy: 1.3427937358975617
Energy: 1.4595452456330484
Energy: 1.3432432879491771
Energy: 1.3429456471134265
Energy: 1.341370644550153
Energy: 1.3436490317272702
Energy: 1.343295666937191
Energy: 1.4641239210520862
Energy: 1.4597525791599077
Energy: 1.342766718464029
Energy: 1.3396656527560558
Energy: 1.4597966001057594
Energy: 1.4605181432071994
Energy: 1.463993312330856
Energy: 1.3437150272056242
Energy: 1.344596851784636
Energy: 1.3416320470440728
Energy: 1.4173895529903784
Energy: 1.3435349391741038
Energy: 1.3515835728226526
Energy: 1.6093726766533458
Energy: 1.3420822074259684
Energy: 1.345416984999576
Energy: 1.3419595495197774
Energy: 1.8918401578427297
Energy: 1.4635063022900257
Energy: 1.3551118929264476
Energy: 1.3469986904619742
Energy: 1.353728855368216
Energy: 1.3466761551123327
Energy: 1.462841497924269
Energy: 1.3592302916394141
Energy: 1.526623019953124
Energy: 1.3582156565129466
Energy: 1.3568080215060718
Energy: 1.3585011021864304
Energy: 1.361434937869254
Energy: 1.361441803929385
Energy: 2.0183331380555956
Energy: 1.3445370544112205
Energy: 1.3553652979414434
Energy: 1.3541970452441123
Energy: 2.016174611535425
Energy: 1.3605355289600474
Energy: 1.451052566713955
Energy: 1.3435168709828633
Energy: 1.3509024211542828
Energy: 1.526759008405452
Energy: 1.358543275421111
Energy: 1.366234559757539
Energy: 1.36358395466488
Energy: 1.4192378536511903
Energy: 1.4818842445165927
Energy: 1.3588552047349065
Energy: 1.3634346960947579
Energy: 1.3487596569871112
Energy: 1.5261231960656592
Energy: 1.4671977574474366
Energy: 1.3413018375653378
Energy: 1.4351870659765245
Energy: 1.4841029967485588
Energy: 1.348723471832034
Energy: 1.3465452494980477
Energy: 1.3548222514715311
Energy: 1.4347676322732201
Energy: 1.355591595512593
Energy: 1.5184187502942632
Energy: 1.366827355720846
Energy: 1.4358849618150338
Energy: 1.491394170711039
Energy: 1.4916299667727302
Energy: 1.4904942373989658
Energy: 1.3646731491416062
Energy: 1.3649022357858815
Energy: 1.3654482038339748
Energy: 1.3444941838816133
Energy: 1.4910911525106731
Energy: 1.3430714686991476
Energy: 1.3659197259592815
Energy: 1.3650989367764184
Energy: 1.3654937507143066
Energy: 1.4337650844589278
Energy: 1.4350279581191547
Energy: 1.3664538830559372
Energy: 1.3661966191451238
Energy: 1.3654716344421642
Energy: 1.3643366416963791
Energy: 1.434122223008665
Energy: 1.3493333747312508
Energy: 1.365552671529992
Energy: 1.3637663322202227
Energy: 1.3642004911414913
Energy: 1.36453116886683
Energy: 1.4341134828671185
Energy: 1.3549232496691617
Energy: 1.4356049117567287
Energy: 1.3647589159042885
Energy: 1.3461050107188925
Energy: 1.3644878197911885
Energy: 1.436581759299993
Energy: 1.4377820102630732
Energy: 1.3432674977748207
Energy: 1.3516596777151393

minimum gb energy = 1.3396656527560558 eV
minimum distance =  2.24697415377337 Angstroms
sigma value = 57


========================================
theta = 141.05755873101862
========================================

Energy: 2.417257541992066
Energy: 1.5149514802049562
Energy: 1.4794777691376793
Energy: 1.4788068363978761
Energy: 1.4909932185352106
Energy: 2.2467136577177427
Energy: 1.460163739216525
Energy: 1.5340040832513755
Energy: 1.5572766149056623
Energy: 1.4784941769584052
Energy: 1.5348237536996954
Energy: 1.4801978802720532
Energy: 1.4779988999867433
Energy: 1.480024290179515
Energy: 1.553678541900456
Energy: 1.5093566625336186
Energy: 1.5573473338757484
Energy: 1.479739761121458
Energy: 1.4794176172676525
Energy: 1.49795753531024
Energy: 1.5559172584676353
Energy: 1.4806755858252159
Energy: 1.4786235259700773
Energy: 1.4999478766349765
Energy: 1.4784102055915636
Energy: 1.497126034562156
Energy: 1.5340768045654103
Energy: 1.4787409077192728
Energy: 1.53457048601595
Energy: 1.4955596416611583
Energy: 1.4781523285956573
Energy: 1.552824459503929
Energy: 1.5599205901123554
Energy: 1.4782559311888184
Energy: 1.5574300816131315
Energy: 1.4799296341234
Energy: 1.4758190742730795
Energy: 1.5340450249854722
Energy: 1.479335032476614
Energy: 1.4794122992751497
Energy: 1.4788590088696978
Energy: 1.5339483661120685
Energy: 1.473484908727734
Energy: 1.5598215754252571
Energy: 1.4796982713289761
Energy: 1.4931175463249167
Energy: 1.4791869192925664
Energy: 1.5340846479734922
Energy: 1.479277795256239
Energy: 1.4809750051870727
Energy: 1.4606183125228278
Energy: 1.4601561207848406
Energy: 1.5354752523126596
Energy: 1.47969448900447
Energy: 1.478274669516951
Energy: 1.4790860601278744
Energy: 1.4604509044586107
Energy: 1.460044109878772
Energy: 1.536256970455284
Energy: 1.4797103946634436
Energy: 1.4601741260910015
Energy: 1.559028784964027
Energy: 1.480208272040139
Energy: 1.4898031740561148
Energy: 1.5547319047382333
Energy: 1.5534356044200115
Energy: 1.460865923097724
Energy: 1.5339791204182973
Energy: 1.4974554162953373
Energy: 1.479876647425593
Energy: 1.4976000053377698
Energy: 1.533438221847446
Energy: 1.4810384084760064
Energy: 1.4799057780372038
Energy: 1.4975254581803852
Energy: 1.4796716763383662
Energy: 1.4953055897663152
Energy: 1.4791086427732312
Energy: 1.4781473005775327
Energy: 1.5571926931800382
Energy: 1.4795498740286768
Energy: 1.4786555029850688
Energy: 1.4943532324071926
Energy: 1.5352149358189404
Energy: 1.4786129790961395
Energy: 1.5336321565100528
Energy: 1.5560723567004475
Energy: 1.4790158800189805
Energy: 1.5344054848687165
Energy: 1.4797566748786524
Energy: 1.4782527833819132
Energy: 1.4788494981443039
Energy: 1.4957017333512719
Energy: 1.4823046210593906
Energy: 1.4942635899104681
Energy: 1.4787095268072887
Energy: 1.4602657327505257
Energy: 1.4800911846985643
Energy: 1.5566224431140578
Energy: 1.4791714306262747
Energy: 1.5350133560780543
Energy: 1.4799053347059679

minimum gb energy = 1.460044109878772 eV
minimum distance =  2.25843572942562 Angstroms
sigma value = 9


========================================
theta = 148.41366190347208
========================================

Energy: 2.592856363927039
Energy: 1.49193995525462
Energy: 1.5297342398307272
Energy: 1.5815462495114372
Energy: 1.5283980147557628
Energy: 1.4926690121528972
Energy: 1.5706331500789374
Energy: 1.6411263065705417
Energy: 1.5432690926760326
Energy: 1.522075235860581
Energy: 1.642214950079665
Energy: 1.5352298407496432
Energy: 1.5256514585554124
Energy: 1.5359786478658095
Energy: 1.7215177399632486
Energy: 1.7206178724188168
Energy: 1.6319018425304714
Energy: 1.5219533174650557
Energy: 1.5535333206589002
Energy: 1.5330681631413499
Energy: 1.6338013733289298
Energy: 1.5248539718363376
Energy: 1.6728897880784566
Energy: 1.5349190676418012
Energy: 1.5240827729872195
Energy: 1.6581810937514432
Energy: 1.548036071260598
Energy: 1.5238458799332977
Energy: 1.6147824149528178
Energy: 1.655694079116205
Energy: 1.5252269828481955
Energy: 1.6339619680205084
Energy: 1.6568617466541014
Energy: 1.525712401570207
Energy: 1.6581578864165996
Energy: 1.5348135062546036
Energy: 1.5265357844353937
Energy: 1.5324372300713216
Energy: 1.5349027300331681
Energy: 1.5241766913682255
Energy: 1.5331735804203541
Energy: 1.6531071461023734
Energy: 1.5248039448784425
Energy: 1.6323607322889822
Energy: 1.5457764917998145
Energy: 1.5225552071063198
Energy: 1.6328318300528064
Energy: 1.5444703795307355
Energy: 1.525708805533157
Energy: 1.5373869555379993
Energy: 1.632949032118166
Energy: 1.523030726542375
Energy: 1.633957879860971
Energy: 1.5319036565246773
Energy: 1.5225334208355823
Energy: 1.5337306265794852
Energy: 1.5413486187532455
Energy: 1.5230153443676877
Energy: 1.6337427689550907
Energy: 1.5442370722846113
Energy: 1.5653518345126338
Energy: 1.631949477838984
Energy: 1.5468132298384933
Energy: 1.5234117223552175
Energy: 1.5467313993574279
Energy: 1.472063742046269
Energy: 1.5622504920123745
Energy: 1.5415896249727545
Energy: 1.5373892940386624
Energy: 1.528205500763419
Energy: 1.5331484186245268
Energy: 1.6681845163429008
Energy: 1.5218743347185575
Energy: 1.5332741014129498
Energy: 1.633196144890686
Energy: 1.4729181915617926
Energy: 1.6323815194744227
Energy: 1.5463049596164162
Energy: 1.5238832067594201
Energy: 1.563744870844865
Energy: 1.5422840538776101
Energy: 1.472799679016498
Energy: 1.5337843896526133
Energy: 1.5338212993716605
Energy: 1.5235663430187962
Energy: 1.6591119966787788
Energy: 1.5333797544650236
Energy: 1.5276204583338995
Energy: 1.6140818406941784
Energy: 1.6572145162122933
Energy: 1.5204408708938797
Energy: 1.616139129798589
Energy: 1.655246130658797
Energy: 1.6564872565457383
Energy: 1.660754714537959
Energy: 1.5266732125066451
Energy: 1.5239453925338047
Energy: 1.672337834894858
Energy: 1.5339106106223186
Energy: 1.5249444115288469
Energy: 1.531945312899031
Energy: 1.5376259054420582
Energy: 1.5271832598433708
Energy: 1.6318249213827645
Energy: 1.5234867403787806
Energy: 1.522196264829901
Energy: 1.5353499458595157
Energy: 1.6317200054629228
Energy: 1.5275747295098596
Energy: 1.5387944854454731
Energy: 1.6416521976013947
Energy: 1.5234689722179413
Energy: 1.5421019852297446
Energy: 1.5369685076440824
Energy: 1.524449553310652
Energy: 1.5225353288314893
Energy: 1.5336349672640734
Energy: 1.537084931919448
Energy: 1.5270420094315327
Energy: 1.5263242992696284
Energy: 1.5800246051218725
Energy: 1.6405478117602943
Energy: 1.5339344128857064
Energy: 1.5471460157045662
Energy: 1.6337881506277745
Energy: 1.5339013528492398

minimum gb energy = 1.472063742046269 eV
minimum distance =  2.26692072737201 Angstroms
sigma value = 27


========================================
theta = 153.4746479833903
========================================

Energy: 1.9977271559255478
Energy: 1.4898383459116464
Energy: 1.5475396068840537
Energy: 1.5491724507643523
Energy: 1.5479830150756064
Energy: 1.4895476736981195
Energy: 1.4895639816178547
Energy: 1.6654696909692175
Energy: 1.5097423527598648
Energy: 1.4929384742833902
Energy: 1.6749256991408523
Energy: 1.4932296623942538
Energy: 1.4796492295490316
Energy: 1.4809348746421525
Energy: 1.7949561707311377
Energy: 1.79408230476001
Energy: 1.664572848051483
Energy: 1.4814232582135947
Energy: 1.483888058650553
Energy: 1.4813549964047297
Energy: 1.4921740539100175
Energy: 1.4926152072829777
Energy: 1.711943283359239
Energy: 1.480539284575452
Energy: 1.4803219921414936
Energy: 1.5881952049601427
Energy: 1.5632686325955154
Energy: 1.4942074685731779
Energy: 1.5629834986622313
Energy: 1.7109538321061366
Energy: 1.4842516926837563
Energy: 1.4838394019974355
Energy: 1.564208358238971
Energy: 1.492330646534473
Energy: 1.561781995041227
Energy: 1.4848265320512208
Energy: 1.4805301260891264
Energy: 1.5886198564642093
Energy: 1.5626986761926236
Energy: 1.493094781341825
Energy: 1.5642297674339065
Energy: 1.5805985403660336
Energy: 1.480259278732028
Energy: 1.7107122986524421
Energy: 1.4936760663706858
Energy: 1.4910321893421334
Energy: 1.7120705853596498
Energy: 1.4868994479959319
Energy: 1.479610402597532
Energy: 1.4828526940096278
Energy: 1.4847800168544292
Energy: 1.483834463129893
Energy: 1.4804590017634145
Energy: 1.4816460648211265
Energy: 1.4791403485425767
Energy: 1.4928563756279494
Energy: 1.5729524660772447
Energy: 1.4838613096271134
Energy: 1.6644494633105964
Energy: 1.481612893172441
Energy: 1.4789162193576428
Energy: 1.6642213243591601
Energy: 1.4918645533581012
Energy: 1.5481739805949963
Energy: 1.493067102156542
Energy: 1.6604624388540001
Energy: 1.479419148528859
Energy: 1.6647367997840925
Energy: 1.492853766610167
Energy: 1.5474970800956471
Energy: 1.4927817608477831
Energy: 1.4839488352543588
Energy: 1.5465537719848368
Energy: 1.4831757934304712
Energy: 1.4772772702023458
Energy: 1.4753033210027855
Energy: 1.4927632809699465
Energy: 1.481086286241237
Energy: 1.4921715326223264
Energy: 1.4934196300657447
Energy: 1.554750126124236
Energy: 1.477046580554739
Energy: 1.6647225147697378
Energy: 1.492654650392398
Energy: 1.4767843023117382
Energy: 1.6643032107750813
Energy: 1.4806001263830542
Energy: 1.4798874114868845
Energy: 1.480176464886377
Energy: 1.7955023784248614
Energy: 1.4776904292381394
Energy: 1.4807929465800542
Energy: 1.4843080794128756
Energy: 1.4848038339190093
Energy: 1.4800984855746007
Energy: 1.6653694121478577
Energy: 1.4939647782230607
Energy: 1.4926721655792656
Energy: 1.710954023892113
Energy: 1.476952844692339
Energy: 1.7120148179166035
Energy: 1.4927551052485035
Energy: 1.4934536643464469
Energy: 1.5623079109964415
Energy: 1.4840094070240275
Energy: 1.483719381231453
Energy: 1.6056059749447442
Energy: 1.5630965658170342
Energy: 1.4923001060260133
Energy: 1.5623178946984824
Energy: 1.4851763497404489
Energy: 1.4835786451839252
Energy: 1.5629205506056891
Energy: 1.562701942152641
Energy: 1.4937018976244039
Energy: 1.4925382824717608
Energy: 1.7145877437859873
Energy: 1.484748342612882
Energy: 1.7116281359798002
Energy: 1.4923276633559308
Energy: 1.480210645004643
Energy: 1.484729946836108
Energy: 1.4844480081423346
Energy: 1.4849499277227962
Energy: 1.4853063797022767
Energy: 1.6653615169655411
Energy: 1.4770069289190426
Energy: 1.6643073479974437
Energy: 1.4812092228645188
Energy: 1.4797880753690222
Energy: 1.480993103061016
Energy: 1.664172729991437
Energy: 1.547078344854595
Energy: 1.4928532869811713
Energy: 1.4822636303279082
Energy: 1.4798977490867928
Energy: 1.6743756890135875
Energy: 1.492070448064844
Energy: 1.5469546339039513
Energy: 1.4812197106563072
Energy: 1.6602970342057222
Energy: 1.4793152306978767
Energy: 1.49307103253893
Energy: 1.5495903485035212
Energy: 1.4765664151311941
Energy: 1.5608747286832048
Energy: 1.4931295896085146
Energy: 1.4801756151652663
Energy: 1.4944373954310166
Energy: 1.4892736538230216

minimum gb energy = 1.4753033210027855 eV
minimum distance =  2.28181415505313 Angstroms
sigma value = 19


========================================
theta = 157.15649268207542
========================================

Energy: 2.1254128840786266
Energy: 1.4303352418918187
Energy: 1.4900486116098304
Energy: 1.48925562405608
Energy: 1.491137029847458
Energy: 1.4309633334342338
Energy: 1.4480178735452314
Energy: 1.4349444049034217
Energy: 1.4474171187504052
Energy: 1.4870021815900558
Energy: 1.438830498583264
Energy: 1.4474760415375947
Energy: 1.4348177391564363
Energy: 1.4390876226730887
Energy: 1.800515191442485
Energy: 1.7999413258134107
Energy: 1.4352876754331387
Energy: 1.4390187877263874
Energy: 1.4383001336040055
Energy: 1.4388151582616533
Energy: 1.4389117161278524
Energy: 1.4463909394574839
Energy: 1.5768980790004636
Energy: 1.438814133962614
Energy: 1.432592675334411
Energy: 1.5713516673676127
Energy: 1.4386596954340067
Energy: 1.438084431899387
Energy: 1.509368715145887
Energy: 1.7199180501443414
Energy: 1.4380543306400386
Energy: 1.438615545575613
Energy: 1.4382877420754574
Energy: 1.438302213090654
Energy: 1.5090144355989583
Energy: 1.4384578886242787
Energy: 1.4472729055925764
Energy: 1.6006431770087546
Energy: 1.601583621215208
Energy: 1.5578269079092704
Energy: 1.6011378395016755
Energy: 1.5585940720771112
Energy: 1.4467979200384
Energy: 1.6011619349532817
Energy: 1.4383404753587186
Energy: 1.4396624612782223
Energy: 1.5473217889478137
Energy: 1.4474249694608505
Energy: 1.4455819384945128
Energy: 1.5095516237838607
Energy: 1.577535190866088
Energy: 1.4355959852015427
Energy: 1.5093411511614998
Energy: 1.5101043819428746
Energy: 1.4466258959225922
Energy: 1.4393697392537939
Energy: 1.5651715758876377
Energy: 1.436212459304222
Energy: 1.7197812264679213
Energy: 1.4401812822526914
Energy: 1.4298634306216116
Energy: 1.4371709237727601
Energy: 1.4356060626094433
Energy: 1.4394881667793311
Energy: 1.435448251815289
Energy: 1.4369199628926994
Energy: 1.4391351342581993
Energy: 1.435928952623897
Energy: 1.4459091293706567
Energy: 1.4398375018557135
Energy: 1.4456285687475343
Energy: 1.4387726145532849
Energy: 1.4872109835109004
Energy: 1.4469812511079176
Energy: 1.433524192122529
Energy: 1.434331191764919
Energy: 1.4383142622633316
Energy: 1.4869640621483273
Energy: 1.4408156083299304
Energy: 1.447654919429845
Energy: 1.4391124994330022
Energy: 1.4331432610795898
Energy: 1.6447501837009324
Energy: 1.4482687413480109
Energy: 1.4281560968387088
Energy: 1.4403231036543802
Energy: 1.486455296584395
Energy: 1.491457475955597
Energy: 1.4368267592554504
Energy: 1.4362103656525633
Energy: 1.432956954623904
Energy: 1.5303573996473412
Energy: 1.4406140552106093
Energy: 1.4359988201888414
Energy: 1.4391800893809832
Energy: 1.4606307889907229
Energy: 1.4415982662259748
Energy: 1.4353014964636006
Energy: 1.8009878032617475
Energy: 1.4309662121434776
Energy: 1.6459212225184918
Energy: 1.4350879441733988
Energy: 1.438517835140433
Energy: 1.4391937918435258
Energy: 1.4391038760406047
Energy: 1.4307926998244063
Energy: 1.4362834185537157
Energy: 1.4393563826186753
Energy: 1.4337160011662557
Energy: 1.7197306668074626
Energy: 1.4388915775555928
Energy: 1.4479629948617898
Energy: 1.5090068521733297
Energy: 1.719730662084048
Energy: 1.4377039622501613
Energy: 1.576833588107027
Energy: 1.509222417298459
Energy: 1.4382444047779124
Energy: 1.509934399116097
Energy: 1.4387362349049975
Energy: 1.438538602542695
Energy: 1.5453923511189687
Energy: 1.6019588344855205
Energy: 1.448632050556201
Energy: 1.601518043482946
Energy: 1.4389721466302083
Energy: 1.446820953823478
Energy: 1.6002033696674645
Energy: 1.4384163865428286
Energy: 1.4387998504204254
Energy: 1.545975498817984
Energy: 1.6009994322041554
Energy: 1.4373542395068142
Energy: 1.5096063225340133
Energy: 1.4476370066874038
Energy: 1.4386846570758176
Energy: 1.5093978179362166
Energy: 1.5105045076909718
Energy: 1.446726889880827
Energy: 1.4381321323798462
Energy: 1.7201333316929417
Energy: 1.4359646113100046
Energy: 1.7192896698378397
Energy: 1.4475876766728606
Energy: 1.4350244238967236
Energy: 1.4380973018991512
Energy: 1.4386048696388423
Energy: 1.4383913486358857
Energy: 1.4354317959195222
Energy: 1.4352890028524024
Energy: 1.429768341752042
Energy: 1.6464261331538073
Energy: 1.4352951918777355
Energy: 1.4421727381002702
Energy: 1.4354369356959564
Energy: 1.645191430115179
Energy: 1.436031016944381
Energy: 1.4479377205884432
Energy: 1.5391775710602011
Energy: 1.4337319204147114
Energy: 1.6444399481269567
Energy: 1.4882359147447475
Energy: 1.4857791840691885
Energy: 1.4367936821856846
Energy: 1.6386879931097815
Energy: 1.4333865569695765
Energy: 1.4383819429712685
Energy: 1.4856693824474785
Energy: 1.4281650774717407
Energy: 1.6448248499710578
Energy: 1.4361549039259625
Energy: 1.4868740265997864
Energy: 1.440400196652226
Energy: 1.4358465389368489

minimum gb energy = 1.4281560968387088 eV
minimum distance =  2.26222436343419 Angstroms
sigma value = 101


========================================
theta = 159.95002427584853
========================================

Energy: 1.434502722337866
Energy: 1.3696486522146913
Energy: 1.4218331608769226
Energy: 1.4218704529295687
Energy: 1.4217710028045079
Energy: 1.7824831640021814
Energy: 1.3831317581860578
Energy: 1.3779242204086255
Energy: 1.3742230998644736
Energy: 1.3748187710710233
Energy: 1.3779896917109224
Energy: 1.3734651362136368
Energy: 1.377206600261447
Energy: 1.3779328719661414
Energy: 1.784416624448295
Energy: 1.783781756386758
Energy: 1.377850393838971
Energy: 1.3778300286458935
Energy: 1.3784133471431144
Energy: 1.3783553746412884
Energy: 1.3777565017295623
Energy: 1.3723766405769915
Energy: 1.377289777862384
Energy: 1.3785023286792664
Energy: 1.3681782980130472
Energy: 1.3750177272473312
Energy: 1.3754239917546633
Energy: 1.3741995717489546
Energy: 1.4488092170622453
Energy: 1.6236046193476852
Energy: 1.3780461896018825
Energy: 1.3775731407584155
Energy: 1.3741965613120601
Energy: 1.3730645280149252
Energy: 1.373442773706881
Energy: 1.3778948292818785
Energy: 1.3779924638027752
Energy: 1.4770614566444498
Energy: 1.5906680205285955
Energy: 1.590580859846666
Energy: 1.5532346206444454
Energy: 1.4778843088520024
Energy: 1.3787000976270443
Energy: 1.477240428464357
Energy: 1.3730621430560932
Energy: 1.3743140528077695
Energy: 1.373151955407471
Energy: 1.3774398395264669
Energy: 1.3787704337319624
Energy: 1.537504873635061
Energy: 1.5505812849110077
Energy: 1.3732174189236028
Energy: 1.552098697437069
Energy: 1.5370517484398452
Energy: 1.3774392901129668
Energy: 1.3768995386127996
Energy: 1.373454319099176
Energy: 1.3725665646206393
Energy: 1.551665382614776
Energy: 1.3778188448568327
Energy: 1.3745085001139232
Energy: 1.4485423332025125
Energy: 1.44871612219308
Energy: 1.375855416661316
Energy: 1.4485042424096006
Energy: 1.3750666368527813
Energy: 1.3749262701303677
Energy: 1.3761552269926323
Energy: 1.3735826905201518
Energy: 1.3722038992631957
Energy: 1.3748212950686334
Energy: 1.3744938396750965
Energy: 1.3791518216416114
Energy: 1.377563432432608
Energy: 1.3780132882783345
Energy: 1.3728852735292811
Energy: 1.3760602468855845
Energy: 1.3776289216554485
Energy: 1.374089092742234
Energy: 1.3774385923491335
Energy: 1.3771667996794308
Energy: 1.3758897371655092
Energy: 1.3777043955521633
Energy: 1.5336608423103841
Energy: 1.374739839191614
Energy: 1.375311356440769
Energy: 1.4224764898177402
Energy: 1.3744288785472876
Energy: 1.3744371916027656
Energy: 1.3742323864061976
Energy: 1.3758387678308772
Energy: 1.4665352826597073
Energy: 1.3741134198146667
Energy: 1.375113044459676
Energy: 1.3742683161550113
Energy: 1.3736407334327496
Energy: 1.4207772563757404
Energy: 1.3766607727765063
Energy: 1.3694695006534263
Energy: 1.3664697049230383
Energy: 1.3777867958997565
Energy: 1.4219069115005012
Energy: 1.3744388617973595
Energy: 1.3741196218747884
Energy: 1.3746807241569294
Energy: 1.382790018466035
Energy: 1.3784037250306838
Energy: 1.3735978965123863
Energy: 1.3693646012338518
Energy: 1.3780803105650177
Energy: 1.378383421895918
Energy: 1.3745339897993094
Energy: 1.3775319127667085
Energy: 1.7855435613842634
Energy: 1.3682389458019235
Energy: 1.3745607869790335
Energy: 1.3780326762028328
Energy: 1.378016156210852
Energy: 1.377775965510367
Energy: 1.377529926789444
Energy: 1.372433537688263
Energy: 1.372815382451803
Energy: 1.7076847913594777
Energy: 1.370330346270051
Energy: 1.3756065316293362
Energy: 1.3729373151986828
Energy: 1.3732724482206848
Energy: 1.375788093653005
Energy: 1.377637036861094
Energy: 1.3787186839678676
Energy: 1.449207758874005
Energy: 1.3737813023484273
Energy: 1.373360671608287
Energy: 1.5915137084436757
Energy: 1.3774538668881118
Energy: 1.3795453001567088
Energy: 1.4773208855663589
Energy: 1.5901399432946348
Energy: 1.3723335874756677
Energy: 1.373381082356122
Energy: 1.4770311432678747
Energy: 1.3783421710011081
Energy: 1.537174102898746
Energy: 1.3743187756105635
Energy: 1.3720949649547192
Energy: 1.5506750018358275
Energy: 1.5361572266859287
Energy: 1.3779880877952357
Energy: 1.5367357695777815
Energy: 1.3744757316910994
Energy: 1.373366122749005
Energy: 1.5901993343068361
Energy: 1.3773883481112126
Energy: 1.3795112208459328
Energy: 1.477444358368408
Energy: 1.5911045292800239
Energy: 1.3734423946673282
Energy: 1.4489876632174443
Energy: 1.4491245154808492
Energy: 1.3747197036204526
Energy: 1.448988515162361
Energy: 1.3736851043049898
Energy: 1.372333704951343
Energy: 1.3752107965865914
Energy: 1.37520676761051
Energy: 1.3748123745174587
Energy: 1.3758508205941693
Energy: 1.375558613491767
Energy: 1.3763127615606603
Energy: 1.3780417315839313
Energy: 1.3775787980439151
Energy: 1.3776149406383178
Energy: 1.3785949045728283
Energy: 1.5315123140248275
Energy: 1.3720251970844277
Energy: 1.3780917549555123
Energy: 1.3789988810108194
Energy: 1.3744962608457965
Energy: 1.3753684068019763
Energy: 1.3786372729210972
Energy: 1.3740934331007748
Energy: 1.3741958083517456
Energy: 1.3776457851938102
Energy: 1.3764076092773845
Energy: 1.373327646070839
Energy: 1.3728179854411877
Energy: 1.3727417640712285
Energy: 1.3762747737360883
Energy: 1.3777935678562816
Energy: 1.3751052363040295
Energy: 1.375252370345899
Energy: 1.3751014612725352
Energy: 1.37923832265027
Energy: 1.377714504348551
Energy: 1.3763971108466688
Energy: 1.3733032963653058
Energy: 1.3732406432980102
Energy: 1.3681765729800115

minimum gb energy = 1.3664697049230383 eV
minimum distance =  2.26870856318723 Angstroms
sigma value = 33


========================================
theta = 180.0
========================================

Energy: 0.014816725687842208
Energy: 0.016025014972801968
Energy: 0.09446191789738051
Energy: 0.09461934567282412
Energy: 0.0960290001878269
Energy: 0.015349042877517403
Energy: 0.014960020978490701
Energy: 0.10810433452787925
Energy: 0.10942526701042134
Energy: 0.10945399788125036
Energy: 0.10822309536517043
Energy: 0.10924908430057334
Energy: 0.9705592771988204
Energy: 0.0982292456030497
Energy: 0.015814156032313953
Energy: 0.016588451278357254
Energy: 0.09525737729861326
Energy: 0.09470041390000664
Energy: 0.10852221844040232
Energy: 0.10810433452787925
Energy: 0.10942526701042134
Energy: 0.10945399788125036
Energy: 0.10822309536446677
Energy: 0.1092490842998697

minimum gb energy = 0.014816725687842208 eV
minimum distance =  2.45968744493539 Angstroms
sigma value = 1